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Structure & Deep Data of N-Methyl-N-nitrosobutyramide (C5H10N2O2)

Identification of N-Methyl-N-nitrosobutyramide Chemical Compound

2D chemical structure image of N-Methyl-N-nitrosobutyramide
Chemical Formula C5H10N2O2
Molecular Weight 130.1451 g/mol
IUPAC Name N-methyl-N'-oxobutanehydrazide
SMILES String CCCC(=O)N(C)N=O
InChI InChI=1S/C5H10N2O2/c1-3-4-5(8)7(2)6-9/h3-4H2,1-2H3
InChIKey XPQQMTYSKBRMIY-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 N-Methyl-N-nitrosobutyramide molecule contains a total of 18 bond(s). There are 8 non-H bond(s), 2 multiple bond(s), 3 rotatable bond(s), 2 double bond(s), and 1 N-nitroso group(s) (aliphatic). Images of the chemical structure of N-Methyl-N-nitrosobutyramide are given below:

2D chemical structure image of N-Methyl-N-nitrosobutyramide
2-dimensional (2D) chemical structure image of N-Methyl-N-nitrosobutyramide
3D chemical structure image of N-Methyl-N-nitrosobutyramide
3-dimensional (3D) chemical structure image of N-Methyl-N-nitrosobutyramide

The 2D chemical structure image of N-Methyl-N-nitrosobutyramide is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of N-Methyl-N-nitrosobutyramide 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 N-Methyl-N-nitrosobutyramide 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 N-Methyl-N-nitrosobutyramide. 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 N-Methyl-N-nitrosobutyramide is provided here.

The N-Methyl-N-nitrosobutyramide 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 N-Methyl-N-nitrosobutyramide 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 N-Methyl-N-nitrosobutyramide 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 N-Methyl-N-nitrosobutyramide Molecule

  • Other names (synonyms) or registry numbers of N-Methyl-N-nitrosobutyramide

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

    • AR-1K7759
    • Butanamide,N-methyl-N-nitroso-
    • N-methyl-N-nitrosobutanamide
    • 16395-81-6
    • Butyramide, N-methyl-N-nitroso-
    • N-Methyl-N-nitrosobutyramide

N-Methyl-N-nitrosobutyramide Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of N-Methyl-N-nitrosobutyramide?
C5H10N2O2
How many atoms and what are the elements included the N-Methyl-N-nitrosobutyramide molecule?
19 atom(s) - 10 Hydrogen atom(s), 5 Carbon atom(s), 2 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the N-Methyl-N-nitrosobutyramide structure?
18 bond(s) - 8 non-H bond(s), 2 multiple bond(s), 3 rotatable bond(s), 2 double bond(s), and 1 N-nitroso group(s) (aliphatic)
What’s the N-Methyl-N-nitrosobutyramide’s molecular weight?
130.1451 g/mol
What’s the SMILES code of N-Methyl-N-nitrosobutyramide?
CCCC(=O)N(C)N=O
What’s the InChI string of N-Methyl-N-nitrosobutyramide?
InChI=1S/C5H10N2O2/c1-3-4-5(8)7(2)6-9/h3-4H2,1-2H3
What’s the InChIKey code of N-Methyl-N-nitrosobutyramide?
XPQQMTYSKBRMIY-UHFFFAOYSA-N

89 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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