N-amino-N-ethylnitrous amide

C2H7N3O — CID 23266213

IUPACN-amino-N-ethylnitrous amide
SMILESCCN(N)N=O
InChIInChI=1S/C2H7N3O/c1-2-5(3)4-6/h2-3H2,1H3
InChIKeyCGQSTTKBCCKMMD-UHFFFAOYSA-N
MW89.10 g/mol
LogP-0.14
Rot. Bonds2

About N-amino-N-ethylnitrous amide

N-amino-N-ethylnitrous amide (PubChem CID 23266213) has the molecular formula C2H7N3O and a molecular weight of 89.10 g/mol. Its IUPAC name is N-amino-N-ethylnitrous amide.

Molecular Properties

Compound NameN-amino-N-ethylnitrous amide
PubChem CID23266213
Molecular FormulaC2H7N3O
Molecular Weight89.10 g/mol
Exact Mass89.06
IUPAC NameN-amino-N-ethylnitrous amide
SMILESCCN(N)N=O
InChIInChI=1S/C2H7N3O/c1-2-5(3)4-6/h2-3H2,1H3
InChIKeyCGQSTTKBCCKMMD-UHFFFAOYSA-N
XLogP-0.14
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.10
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1,2-13C2)ethyl-N-(113C)methylnitrous amide
CID 171380411
1-ethyl-1-nitrosourea
CID 159023173
(3Z)-3-amino-3-[amino(ethyl)hydrazinylidene]propanoic acid
CID 143455863
N-amino-N-nitrosopentanamide
CID 172967677
3-[ethyl(nitroso)amino]propanamide
CID 172967454
N-[2-(dimethylamino)ethyl]-N-ethylnitrous amide
CID 156620436
N,N-diethylethanamine;1,1-dimethylhydrazine
CID 87141357
azane;ethanol;nitrous acid
CID 174524310
1,1-diethylhydrazine;ethene
CID 87605670
N-ethyl-N-(1,1,2,2-tetradeuterioethyl)nitrous amide
CID 126456058
azane;N,N-dimethylethanamine
CID 91593223
CID 175820473
CID 175820473

Frequently Asked Questions

What is the IUPAC name of N-amino-N-ethylnitrous amide?
The IUPAC name of N-amino-N-ethylnitrous amide (CID 23266213) is N-amino-N-ethylnitrous amide.
What is the SMILES notation for N-amino-N-ethylnitrous amide?
The canonical SMILES for N-amino-N-ethylnitrous amide is CCN(N)N=O.
What is the InChIKey of N-amino-N-ethylnitrous amide?
The InChIKey is CGQSTTKBCCKMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N3O/c1-2-5(3)4-6/h2-3H2,1H3.
What are the key properties of N-amino-N-ethylnitrous amide?
N-amino-N-ethylnitrous amide has a molecular weight of 89.10 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-ethylnitrous amide is sourced from PubChem (CID 23266213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).