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Structure & Deep Data of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one (C19H27NO2)

Identification of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one Chemical Compound

2D chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one
Chemical Formula C19H27NO2
Molecular Weight 301.42318 g/mol
IUPAC Name 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one
SMILES String CC1COCC(C)N1C(=O)CC(C2CC2)c3ccc(C)cc3
InChI InChI=1S/C19H27NO2/c1-13-4-6-16(7-5-13)18(17-8-9-17)10-19(21)20-14(2)11-22-12-15(20)3/h4-7,14-15,17-18H,8-12H2,1-3H3
InChIKey LRJFNKYSIFIGDN-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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one molecule contains a total of 51 bond(s). There are 24 non-H bond(s), 7 multiple bond(s), 4 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 three-membered ring(s), 2 six-membered ring(s), 1 tertiary amide(s) (aliphatic), and 1 ether(s) (aliphatic). Images of the chemical structure of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one are given below:

2D chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one
2-dimensional (2D) chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one
3D chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one
3-dimensional (3D) chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one

The 2D chemical structure image of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one 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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one 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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one. Download structure data file (SDF/MOL) file of this compound.


Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one is provided here.

The 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one 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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one 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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one 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 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one Molecule

  • Other names (synonyms) or registry numbers of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one

    The 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one including the various registry numbers, if available:



    None available.


3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one?
C19H27NO2
How many atoms and what are the elements included the 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one molecule?
49 atom(s) - 27 Hydrogen atom(s), 19 Carbon atom(s), 1 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one structure?
51 bond(s) - 24 non-H bond(s), 7 multiple bond(s), 4 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 three-membered ring(s), 2 six-membered ring(s), 1 tertiary amide(s) (aliphatic), and 1 ether(s) (aliphatic)
What’s the 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one’s molecular weight?
301.42318 g/mol
What’s the SMILES code of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one?
CC1COCC(C)N1C(=O)CC(C2CC2)c3ccc(C)cc3
What’s the InChI string of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one?
InChI=1S/C19H27NO2/c1-13-4-6-16(7-5-13)18(17-8-9-17)10-19(21)20-14(2)11-22-12-15(20)3/h4-7,14-15,17-18H,8-12H2,1-3H3
What’s the InChIKey code of 3-cyclopropyl-1-(3,5-dimethylmorpholin-4-yl)-3-(4-methylphenyl)propan-1-one?
LRJFNKYSIFIGDN-UHFFFAOYSA-N

43 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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