Home Structure This Compound
loading

Structure & Deep Data of Tripelennamine (C16H21N3)

Identification of Tripelennamine Chemical Compound

2D chemical structure image of tripelennamine
Chemical Formula C16H21N3
Molecular Weight 255.35804 g/mol
IUPAC Name N-benzyl-N-[2-(dimethylamino)ethyl]pyridin-2-amine
SMILES String CN(C)CCN(Cc1ccccc1)c2ccccn2
InChI InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKey UFLGIAIHIAPJJC-UHFFFAOYSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The tripelennamine molecule contains a total of 41 bond(s). There are 20 non-H bond(s), 12 multiple bond(s), 6 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 tertiary amine(s) (aliphatic), 1 tertiary amine(s) (aromatic), and 1 Pyridine(s). Images of the chemical structure of tripelennamine are given below:

2D chemical structure image of tripelennamine
2-dimensional (2D) chemical structure image of tripelennamine
3D chemical structure image of tripelennamine
3-dimensional (3D) chemical structure image of tripelennamine

The 2D chemical structure image of tripelennamine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of tripelennamine are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of tripelennamine is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of tripelennamine. Download structure data file (SDF/MOL) file of this compound.


chemical table area

loading image

Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of tripelennamine is provided here.

The tripelennamine molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the tripelennamine molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of tripelennamine can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.


Search Another Chemical Structure

Enter another compound to search for chemical structure:

Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

Input example for Ethanol:

  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
  • InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

Additional Information for Identifying Tripelennamine Molecule

  • SMILES (Simplified Molecular-Input Line-Entry System) string of tripelennamine

    The SMILES string of tripelennamine is CN(C)CCN(Cc1ccccc1)c2ccccn2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the tripelennamine.

  • Structure Data File (SDF/MOL File) of tripelennamine

    The structure data file (SDF/MOL File) of tripelennamine is available for download in the SDF page of tripelennamine, which provides the information about the atoms, bonds, connectivity and coordinates of tripelennamine. The tripelennamine structure data file can be imported to most of the cheminformatics software systems and applications.

  • Chemical formula of tripelennamine

    The molecular formula of tripelennamine is available in chemical formula page of tripelennamine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

  • Molecular weight of tripelennamine

    The molecular weight of tripelennamine is available in molecular weight page of tripelennamine, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

  • Other names (synonyms) or registry numbers of tripelennamine

    The tripelennamine compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of tripelennamine including the various registry numbers, if available:

    • Pyribenzaminereg
    • 1,2-Ethanediamine,N1,N1-dimethyl-N2-(phenylmethyl)-N2-2-pyridinyl-
    • N1-Benzyl-N2,N2-dimethyl-N1-(pyridin-2-yl)ethane-1,2-diamine
    • N-Benzyl-N',N'-dimethyl-N-pyridin-2-ylethane-1,2-diamine
    • 1, N,N-dimethyl-N'-(phenylmethyl)-N'-2-pyridinyl-
    • SBI-0051548.P002
    • CAS_91-81-6
    • AntiAllergicum Medivet (Salt/Mix)
    • Vaginex W Tripelennamine Crm 2%
    • BDBM81471
    • GTPL7318
    • 3C5ORO99TY
    • Tri-Tumine (Salt/Mix)
    • Pyribenzamine Tab 50mg
    • Stanzamine (Salt/Mix)
    • Ahistamin (Salt/Mix)
    • nchembio747-comp17
    • Dehistin (Salt/Mix)
    • ReCovr (Salt/Mix)
    • Vagin-X
    • Bug Bite Balm
    • Tripel
    • N-Benzyl-N',N'-Dimethyl-N-Pyridin-2-Yl-Ethane-1,2-Diamine Hydrochloride
    • 1,2-Ethanediamine, N,N-dimethyl-N'-(phenylmethyl)-N'-2-pyridinyl- (9CI)
    • N,N-dimethyl-N'-(phenylmethyl)-N'-pyridin-2-ylethane-1,2-diamine
    • N'-benzyl-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
    • N-Benzyl-N',N'-dimethyl-N-2-(pyridylethylene)diamine
    • BRD-K57033106-048-02-8
    • 2-[N-Benzyl-N-(2-dimethylaminoethyl)amino]pyridine
    • L000603
    • 2-(benzyl(2-(dimethylamino)ethyl)amino)pyridine
    • D08645
    • Benzyl-(.alpha.-pyridyl)-dimethylaethylendiamin
    • 58044-99-8 (maleate (1:1))
    • 6138-56-3 (citrate (1:1))
    • N,N-Dimethyl-N'-benzyl-N'-(.alpha.-pyridyl)ethylenediamine
    • 2750 R.P
    • N-Benzyl-N',N'-dimethyl-N-(2-pyridyl)ethylenediamine
    • Pyridine, 2-[benzyl[2-(dimethylamino)ethyl]amino]-
    • 154-69-8 (mono-hydrochloride)
    • 22306-05-4 (hydrochloride)
    • N,N-Dimethyl-N'-(phenylmethyl)-N'-2-pyridinyl-1,2-ethanediamine
    • .beta.-Dimethylaminoethyl-2-pyridylaminotoluene
    • Benzyl-.alpha.-pyridyl-dimethyl-aethylendiamin
    • .beta.-Dimethylaminoethyl-2-pyridylbenzylamine
    • Benzyl-(alpha-pyridyl)-dimethylaethylendiamin
    • N,N-Dimethyl-N'-benzyl-N'-(alpha-pyridyl)ethylenediamine
    • Benzyl-(alpha-pyridyl)-dimethylaethylendiamin [German]
    • Pyridine, 2-(benzyl(2-(dimethylamino)ethyl)amino)-
    • Pbz-Sr
    • Ethylenediamine, N-benzyl-N',N'-dimethyl-N-(2-pyridyl)-
    • C16H21N3
    • 2-[Benzyl(2-dimethylaminoethyl)amino]pyridine
    • 2-(Benzyl(2-dimethylaminoethyl)amino)pyridine
    • beta-Dimethylaminoethyl-2-pyridylaminotoluene
    • beta-Dimethylaminoethyl-2-pyridylbenzylamine
    • 2750 R.P.
    • N-Benzyl-N',N'-dimethyl-N-2-pyridylethylenediamine
    • 2-(N-Benzyl-N-(2-dimethylaminoethyl)amino)pyridine
    • Tripelennamine (INN)
    • Tripelennamine Citrate (1:1)
    • N-Benzyl-N-(2-pyridyl)-N',N'-dimethyl ethylenediamine
    • N,N-Dimethyl-N'-benzyl-N'-(2-pyridyl)ethylenediamine
    • 1,2-Ethanediamine, N,N-dimethyl-N'-(phenylmethyl)-N'-2-pyridinyl-
    • Pyristine (piristina)
    • Tripelennaminum [INN-Latin]
    • Tripelenamina [INN-Spanish]
    • Tripelennamina [Italian]
    • Tripelennamine [INN]
    • Tripelennamine [BAN]
    • Triplennamine
    • Tripellenamine
    • Tripelenamina
    • Pyridbenzamine
    • 91-81-6
    • Ts and Blues
    • Vetibenzamina
    • Tripelennaminum
    • Tripelannamine
    • Tripelenamine
    • Pyribenzamin
    • Tripelennamina
    • Tonaril
    • Cizaron
    • Resistamine
    • Piribenzil
    • Benzoxale
    • Pyrinamine base
    • Tripelennamin
    • Pyribenzamine
    • tripelennamine
    • Dehistin

Tripelennamine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of tripelennamine?
C16H21N3
How many atoms and what are the elements included the tripelennamine molecule?
40 atom(s) - 21 Hydrogen atom(s), 16 Carbon atom(s), and 3 Nitrogen atom(s)
How many chemical bonds and what kind of bonds are included the tripelennamine structure?
41 bond(s) - 20 non-H bond(s), 12 multiple bond(s), 6 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 tertiary amine(s) (aliphatic), 1 tertiary amine(s) (aromatic), and 1 Pyridine(s)
What’s the tripelennamine’s molecular weight?
255.35804 g/mol
What’s the SMILES code of tripelennamine?
CN(C)CCN(Cc1ccccc1)c2ccccn2
What’s the InChI string of tripelennamine?
InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
What’s the InChIKey code of tripelennamine?
UFLGIAIHIAPJJC-UHFFFAOYSA-N

1187 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

Subscribe to our newsletter

Join our subscribers list to get the latest news, updates and special offers delivered directly in your inbox.