N-iminonitramide

HN3O2 — CID 57419430

IUPACN-iminonitramide
SMILES[H]/N=N/[N+](=O)[O-]
InChIInChI=1S/HN3O2/c1-2-3(4)5/h1H/b2-1+
InChIKeyNNXAPVADOJOXSL-OWOJBTEDSA-N
MW75.03 g/mol
LogP0.21
Rot. Bonds1

About N-iminonitramide

N-iminonitramide (PubChem CID 57419430) has the molecular formula HN3O2 and a molecular weight of 75.03 g/mol. Its IUPAC name is N-iminonitramide.

Molecular Properties

Compound NameN-iminonitramide
PubChem CID57419430
Molecular FormulaHN3O2
Molecular Weight75.03 g/mol
Exact Mass75.01
IUPAC NameN-iminonitramide
SMILES[H]/N=N/[N+](=O)[O-]
InChIInChI=1S/HN3O2/c1-2-3(4)5/h1H/b2-1+
InChIKeyNNXAPVADOJOXSL-OWOJBTEDSA-N
XLogP0.21
TPSA79.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.03
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'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-iminonitramide?
The IUPAC name of N-iminonitramide (CID 57419430) is N-iminonitramide.
What is the SMILES notation for N-iminonitramide?
The canonical SMILES for N-iminonitramide is [H]/N=N/[N+](=O)[O-].
What is the InChIKey of N-iminonitramide?
The InChIKey is NNXAPVADOJOXSL-OWOJBTEDSA-N. The full InChI is InChI=1S/HN3O2/c1-2-3(4)5/h1H/b2-1+.
What are the key properties of N-iminonitramide?
N-iminonitramide has a molecular weight of 75.03 g/mol, XLogP of 0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-iminonitramide is sourced from PubChem (CID 57419430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).