azanium formate

CH5NO2 — CID 2723923

IUPACazanium formate
SMILESO=C[O-].[NH4+]
InChIInChI=1S/CH2O2.H3N/c2-1-3;/h1H,(H,2,3);1H3
InChIKeyVZTDIZULWFCMLS-UHFFFAOYSA-N
MW63.06 g/mol
LogP-1.26
Rot. Bonds

About azanium formate

azanium formate (PubChem CID 2723923) has the molecular formula CH5NO2 and a molecular weight of 63.06 g/mol. Its IUPAC name is azanium formate.

Molecular Properties

Compound Nameazanium formate
PubChem CID2723923
Molecular FormulaCH5NO2
Molecular Weight63.06 g/mol
Exact Mass63.03
IUPAC Nameazanium formate
SMILESO=C[O-].[NH4+]
InChIInChI=1S/CH2O2.H3N/c2-1-3;/h1H,(H,2,3);1H3
InChIKeyVZTDIZULWFCMLS-UHFFFAOYSA-N
XLogP-1.26
TPSA76.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.06
LogP ≤ 5-1.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azanium formate?
The IUPAC name of azanium formate (CID 2723923) is azanium formate.
What is the SMILES notation for azanium formate?
The canonical SMILES for azanium formate is O=C[O-].[NH4+].
What is the InChIKey of azanium formate?
The InChIKey is VZTDIZULWFCMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O2.H3N/c2-1-3;/h1H,(H,2,3);1H3.
What are the key properties of azanium formate?
azanium formate has a molecular weight of 63.06 g/mol, XLogP of -1.26, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanium formate is sourced from PubChem (CID 2723923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).