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Structure & Deep Data of Diethyl(pentan-3-yl)amine (C9H21N)

Identification of Diethyl(pentan-3-yl)amine Chemical Compound

2D chemical structure image of diethyl(pentan-3-yl)amine
Chemical Formula C9H21N
Molecular Weight 143.26974 g/mol
IUPAC Name diethyl(pentan-3-yl)amine
SMILES String CCC(CC)N(CC)CC
InChI InChI=1S/C9H21N/c1-5-9(6-2)10(7-3)8-4/h9H,5-8H2,1-4H3
InChIKey XQNPPJUYXDHJGI-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 diethyl(pentan-3-yl)amine molecule contains a total of 30 bond(s). There are 9 non-H bond(s), 5 rotatable bond(s), and 1 tertiary amine(s) (aliphatic). Images of the chemical structure of diethyl(pentan-3-yl)amine are given below:

2D chemical structure image of diethyl(pentan-3-yl)amine
2-dimensional (2D) chemical structure image of diethyl(pentan-3-yl)amine
3D chemical structure image of diethyl(pentan-3-yl)amine
3-dimensional (3D) chemical structure image of diethyl(pentan-3-yl)amine

The 2D chemical structure image of diethyl(pentan-3-yl)amine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of diethyl(pentan-3-yl)amine 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 diethyl(pentan-3-yl)amine 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 diethyl(pentan-3-yl)amine. Download structure data file (SDF/MOL) file of this compound.


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Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of diethyl(pentan-3-yl)amine is provided here.

The diethyl(pentan-3-yl)amine 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 diethyl(pentan-3-yl)amine 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 diethyl(pentan-3-yl)amine 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.


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Additional Information for Identifying Diethyl(pentan-3-yl)amine Molecule

  • Other names (synonyms) or registry numbers of diethyl(pentan-3-yl)amine

    The diethyl(pentan-3-yl)amine compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of diethyl(pentan-3-yl)amine including the various registry numbers, if available:



    None available.


Diethyl(pentan-3-yl)amine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of diethyl(pentan-3-yl)amine?
C9H21N
How many atoms and what are the elements included the diethyl(pentan-3-yl)amine molecule?
31 atom(s) - 21 Hydrogen atom(s), 9 Carbon atom(s), and 1 Nitrogen atom(s)
How many chemical bonds and what kind of bonds are included the diethyl(pentan-3-yl)amine structure?
30 bond(s) - 9 non-H bond(s), 5 rotatable bond(s), and 1 tertiary amine(s) (aliphatic)
What’s the diethyl(pentan-3-yl)amine’s molecular weight?
143.26974 g/mol
What’s the SMILES code of diethyl(pentan-3-yl)amine?
CCC(CC)N(CC)CC
What’s the InChI string of diethyl(pentan-3-yl)amine?
InChI=1S/C9H21N/c1-5-9(6-2)10(7-3)8-4/h9H,5-8H2,1-4H3
What’s the InChIKey code of diethyl(pentan-3-yl)amine?
XQNPPJUYXDHJGI-UHFFFAOYSA-N

38 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).

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