N-amino-N-phenylnitrous amide;azane

C6H10N4O — CID 174470664

IUPACN-amino-N-phenylnitrous amide;azane
SMILESN.NN(N=O)c1ccccc1
InChIInChI=1S/C6H7N3O.H3N/c7-9(8-10)6-4-2-1-3-5-6;/h1-5H,7H2;1H3
InChIKeyDCEICPVTLVPVBY-UHFFFAOYSA-N
MW154.17 g/mol
LogP1.21
Rot. Bonds2

About N-amino-N-phenylnitrous amide;azane

N-amino-N-phenylnitrous amide;azane (PubChem CID 174470664) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is N-amino-N-phenylnitrous amide;azane.

Molecular Properties

Compound NameN-amino-N-phenylnitrous amide;azane
PubChem CID174470664
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC NameN-amino-N-phenylnitrous amide;azane
SMILESN.NN(N=O)c1ccccc1
InChIInChI=1S/C6H7N3O.H3N/c7-9(8-10)6-4-2-1-3-5-6;/h1-5H,7H2;1H3
InChIKeyDCEICPVTLVPVBY-UHFFFAOYSA-N
XLogP1.21
TPSA93.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

manganese(2+);bis(N-oxido-N-phenylnitrous amide)
CID 131874368
N-(2-aminoethyl)-N-phenylnitrous amide;hydrochloride
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N-isocyanato-N-phenylnitrous amide
CID 172967685
azane;N,N-diphenylaniline;methane
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1-fluoro-1-phenylhydrazine;hydrochloride
CID 53400318
1-iodo-1-phenylhydrazine;hydrochloride
CID 53433717
N-phenylpropanehydrazide
CID 18522904
2-(N-aminoanilino)acetaldehyde
CID 57249994
1,1-diphenylurea
CID 174849888
2-amino-N-phenylacetohydrazide
CID 70067236
N,N-bis(sulfanyl)aniline;hydrazine
CID 159490218
N,N-diphenylaniline;silane
CID 131739129

Frequently Asked Questions

What is the IUPAC name of N-amino-N-phenylnitrous amide;azane?
The IUPAC name of N-amino-N-phenylnitrous amide;azane (CID 174470664) is N-amino-N-phenylnitrous amide;azane.
What is the SMILES notation for N-amino-N-phenylnitrous amide;azane?
The canonical SMILES for N-amino-N-phenylnitrous amide;azane is N.NN(N=O)c1ccccc1.
What is the InChIKey of N-amino-N-phenylnitrous amide;azane?
The InChIKey is DCEICPVTLVPVBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O.H3N/c7-9(8-10)6-4-2-1-3-5-6;/h1-5H,7H2;1H3.
What are the key properties of N-amino-N-phenylnitrous amide;azane?
N-amino-N-phenylnitrous amide;azane has a molecular weight of 154.17 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-phenylnitrous amide;azane is sourced from PubChem (CID 174470664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).