amino-imino-oxidoazanium

H3N3O — CID 152756478

IUPACamino-imino-oxidoazanium
SMILES[H]/N=[N+](/N)[O-]
InChIInChI=1S/H3N3O/c1-3(2)4/h(H3,1,2)
InChIKeySOUWSUSCICNCSE-UHFFFAOYSA-N
MW61.04 g/mol
LogP-0.60
Rot. Bonds

About amino-imino-oxidoazanium

amino-imino-oxidoazanium (PubChem CID 152756478) has the molecular formula H3N3O and a molecular weight of 61.04 g/mol. Its IUPAC name is amino-imino-oxidoazanium.

Molecular Properties

Compound Nameamino-imino-oxidoazanium
PubChem CID152756478
Molecular FormulaH3N3O
Molecular Weight61.04 g/mol
Exact Mass61.03
IUPAC Nameamino-imino-oxidoazanium
SMILES[H]/N=[N+](/N)[O-]
InChIInChI=1S/H3N3O/c1-3(2)4/h(H3,1,2)
InChIKeySOUWSUSCICNCSE-UHFFFAOYSA-N
XLogP-0.60
TPSA75.94 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50061.04
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
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': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of amino-imino-oxidoazanium?
The IUPAC name of amino-imino-oxidoazanium (CID 152756478) is amino-imino-oxidoazanium.
What is the SMILES notation for amino-imino-oxidoazanium?
The canonical SMILES for amino-imino-oxidoazanium is [H]/N=[N+](/N)[O-].
What is the InChIKey of amino-imino-oxidoazanium?
The InChIKey is SOUWSUSCICNCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N3O/c1-3(2)4/h(H3,1,2).
What are the key properties of amino-imino-oxidoazanium?
amino-imino-oxidoazanium has a molecular weight of 61.04 g/mol, XLogP of -0.60, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for amino-imino-oxidoazanium is sourced from PubChem (CID 152756478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).