formamido sulfite

CH2NO4S- — CID 57253226

IUPACformamido sulfite
SMILESO=CNOS(=O)[O-]
InChIInChI=1S/CH3NO4S/c3-1-2-6-7(4)5/h1H,(H,2,3)(H,4,5)/p-1
InChIKeyRKQATIWRSSQWQC-UHFFFAOYSA-M
MW124.10 g/mol
LogP-1.54
Rot. Bonds3

About formamido sulfite

formamido sulfite (PubChem CID 57253226) has the molecular formula CH2NO4S- and a molecular weight of 124.10 g/mol. Its IUPAC name is formamido sulfite.

Molecular Properties

Compound Nameformamido sulfite
PubChem CID57253226
Molecular FormulaCH2NO4S-
Molecular Weight124.10 g/mol
Exact Mass123.97
IUPAC Nameformamido sulfite
SMILESO=CNOS(=O)[O-]
InChIInChI=1S/CH3NO4S/c3-1-2-6-7(4)5/h1H,(H,2,3)(H,4,5)/p-1
InChIKeyRKQATIWRSSQWQC-UHFFFAOYSA-M
XLogP-1.54
TPSA78.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.10
LogP ≤ 5-1.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

Analyze formamido sulfite 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 formamido sulfite?
The IUPAC name of formamido sulfite (CID 57253226) is formamido sulfite.
What is the SMILES notation for formamido sulfite?
The canonical SMILES for formamido sulfite is O=CNOS(=O)[O-].
What is the InChIKey of formamido sulfite?
The InChIKey is RKQATIWRSSQWQC-UHFFFAOYSA-M. The full InChI is InChI=1S/CH3NO4S/c3-1-2-6-7(4)5/h1H,(H,2,3)(H,4,5)/p-1.
What are the key properties of formamido sulfite?
formamido sulfite has a molecular weight of 124.10 g/mol, XLogP of -1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for formamido sulfite is sourced from PubChem (CID 57253226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).