N-iminonitrous amide

HN3O — CID 57429254

IUPACN-iminonitrous amide
SMILES[H]/N=N/N=O
InChIInChI=1S/HN3O/c1-2-3-4/h1H/b2-1+
InChIKeyDLEPSVFTDBBTRX-OWOJBTEDSA-N
MW59.03 g/mol
LogP0.70
Rot. Bonds1

About N-iminonitrous amide

N-iminonitrous amide (PubChem CID 57429254) has the molecular formula HN3O and a molecular weight of 59.03 g/mol. Its IUPAC name is N-iminonitrous amide.

Molecular Properties

Compound NameN-iminonitrous amide
PubChem CID57429254
Molecular FormulaHN3O
Molecular Weight59.03 g/mol
Exact Mass59.01
IUPAC NameN-iminonitrous amide
SMILES[H]/N=N/N=O
InChIInChI=1S/HN3O/c1-2-3-4/h1H/b2-1+
InChIKeyDLEPSVFTDBBTRX-OWOJBTEDSA-N
XLogP0.70
TPSA65.64 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50059.03
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-iminonitrous amide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-iminonitrous amide?
The IUPAC name of N-iminonitrous amide (CID 57429254) is N-iminonitrous amide.
What is the SMILES notation for N-iminonitrous amide?
The canonical SMILES for N-iminonitrous amide is [H]/N=N/N=O.
What is the InChIKey of N-iminonitrous amide?
The InChIKey is DLEPSVFTDBBTRX-OWOJBTEDSA-N. The full InChI is InChI=1S/HN3O/c1-2-3-4/h1H/b2-1+.
What are the key properties of N-iminonitrous amide?
N-iminonitrous amide has a molecular weight of 59.03 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-iminonitrous amide is sourced from PubChem (CID 57429254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).