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Structure & Deep Data of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane (C12H21NO)

Identification of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane Chemical Compound

2D chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane
Chemical Formula C12H21NO
Molecular Weight 195.30124 g/mol
IUPAC Name (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane
SMILES String CC1CCC2CCCC3COCN1C23
InChI InChI=1S/C12H21NO/c1-9-5-6-10-3-2-4-11-7-14-8-13(9)12(10)11/h9-12H,2-8H2,1H3/t9-,10+,11-,12-/m0/s1
InChIKey GGPGXYJPPAAWKO-USZNOCQGSA-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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane molecule contains a total of 37 bond(s). There are 16 non-H bond(s), 3 six-membered ring(s), 3 ten-membered ring(s), 1 twelve-membered ring(s), 1 tertiary amine(s) (aliphatic), and 1 ether(s) (aliphatic). Images of the chemical structure of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane are given below:

2D chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane
2-dimensional (2D) chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane
3D chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane
3-dimensional (3D) chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane

The 2D chemical structure image of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane. 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane is provided here.

The (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane 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 (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane Molecule

  • Other names (synonyms) or registry numbers of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane

    The (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane including the various registry numbers, if available:



    None available.


(5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane?
C12H21NO
How many atoms and what are the elements included the (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane molecule?
35 atom(s) - 21 Hydrogen atom(s), 12 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane structure?
37 bond(s) - 16 non-H bond(s), 3 six-membered ring(s), 3 ten-membered ring(s), 1 twelve-membered ring(s), 1 tertiary amine(s) (aliphatic), and 1 ether(s) (aliphatic)
What’s the (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane’s molecular weight?
195.30124 g/mol
What’s the SMILES code of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane?
CC1CCC2CCCC3COCN1C23
What’s the InChI string of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane?
InChI=1S/C12H21NO/c1-9-5-6-10-3-2-4-11-7-14-8-13(9)12(10)11/h9-12H,2-8H2,1H3/t9-,10+,11-,12-/m0/s1
What’s the InChIKey code of (5R,9R,12S,13S)-12-methyl-3-oxa-1-azatricyclo[7.3.1.0^{5,13}]tridecane?
GGPGXYJPPAAWKO-USZNOCQGSA-N

39 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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