N-methoxy-N-(methylamino)nitrous amide

C2H7N3O2 — CID 20632144

IUPACN-methoxy-N-(methylamino)nitrous amide
SMILESCNN(N=O)OC
InChIInChI=1S/C2H7N3O2/c1-3-5(4-6)7-2/h3H,1-2H3
InChIKeyHFTGBIVOVSIJHS-UHFFFAOYSA-N
MW105.10 g/mol
LogP-0.33
Rot. Bonds3

About N-methoxy-N-(methylamino)nitrous amide

N-methoxy-N-(methylamino)nitrous amide (PubChem CID 20632144) has the molecular formula C2H7N3O2 and a molecular weight of 105.10 g/mol. Its IUPAC name is N-methoxy-N-(methylamino)nitrous amide.

Molecular Properties

Compound NameN-methoxy-N-(methylamino)nitrous amide
PubChem CID20632144
Molecular FormulaC2H7N3O2
Molecular Weight105.10 g/mol
Exact Mass105.05
IUPAC NameN-methoxy-N-(methylamino)nitrous amide
SMILESCNN(N=O)OC
InChIInChI=1S/C2H7N3O2/c1-3-5(4-6)7-2/h3H,1-2H3
InChIKeyHFTGBIVOVSIJHS-UHFFFAOYSA-N
XLogP-0.33
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.10
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-(methylamino)nitrous amide?
The IUPAC name of N-methoxy-N-(methylamino)nitrous amide (CID 20632144) is N-methoxy-N-(methylamino)nitrous amide.
What is the SMILES notation for N-methoxy-N-(methylamino)nitrous amide?
The canonical SMILES for N-methoxy-N-(methylamino)nitrous amide is CNN(N=O)OC.
What is the InChIKey of N-methoxy-N-(methylamino)nitrous amide?
The InChIKey is HFTGBIVOVSIJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N3O2/c1-3-5(4-6)7-2/h3H,1-2H3.
What are the key properties of N-methoxy-N-(methylamino)nitrous amide?
N-methoxy-N-(methylamino)nitrous amide has a molecular weight of 105.10 g/mol, XLogP of -0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-(methylamino)nitrous amide is sourced from PubChem (CID 20632144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).