azidooxymethane

CH3N3O — CID 18427765

IUPACazidooxymethane
SMILESCON=[N+]=[N-]
InChIInChI=1S/CH3N3O/c1-5-4-3-2/h1H3
InChIKeyRKGIWWSFOSPCCZ-UHFFFAOYSA-N
MW73.05 g/mol
LogP0.86
Rot. Bonds1

About azidooxymethane

azidooxymethane (PubChem CID 18427765) has the molecular formula CH3N3O and a molecular weight of 73.05 g/mol. Its IUPAC name is azidooxymethane.

Molecular Properties

Compound Nameazidooxymethane
PubChem CID18427765
Molecular FormulaCH3N3O
Molecular Weight73.05 g/mol
Exact Mass73.03
IUPAC Nameazidooxymethane
SMILESCON=[N+]=[N-]
InChIInChI=1S/CH3N3O/c1-5-4-3-2/h1H3
InChIKeyRKGIWWSFOSPCCZ-UHFFFAOYSA-N
XLogP0.86
TPSA57.99 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.05
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azidooxymethane?
The IUPAC name of azidooxymethane (CID 18427765) is azidooxymethane.
What is the SMILES notation for azidooxymethane?
The canonical SMILES for azidooxymethane is CON=[N+]=[N-].
What is the InChIKey of azidooxymethane?
The InChIKey is RKGIWWSFOSPCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3N3O/c1-5-4-3-2/h1H3.
What are the key properties of azidooxymethane?
azidooxymethane has a molecular weight of 73.05 g/mol, XLogP of 0.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azidooxymethane is sourced from PubChem (CID 18427765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).