3-sulfamoylprop-2-enamide

C3H6N2O3S — CID 142050789

IUPAC3-sulfamoylprop-2-enamide
SMILESNC(=O)C=CS(N)(=O)=O
InChIInChI=1S/C3H6N2O3S/c4-3(6)1-2-9(5,7)8/h1-2H,(H2,4,6)(H2,5,7,8)
InChIKeyHTGVXHLCKKMDID-UHFFFAOYSA-N
MW150.16 g/mol
LogP-1.73
Rot. Bonds2

About 3-sulfamoylprop-2-enamide

3-sulfamoylprop-2-enamide (PubChem CID 142050789) has the molecular formula C3H6N2O3S and a molecular weight of 150.16 g/mol. Its IUPAC name is 3-sulfamoylprop-2-enamide.

Molecular Properties

Compound Name3-sulfamoylprop-2-enamide
PubChem CID142050789
Molecular FormulaC3H6N2O3S
Molecular Weight150.16 g/mol
Exact Mass150.01
IUPAC Name3-sulfamoylprop-2-enamide
SMILESNC(=O)C=CS(N)(=O)=O
InChIInChI=1S/C3H6N2O3S/c4-3(6)1-2-9(5,7)8/h1-2H,(H2,4,6)(H2,5,7,8)
InChIKeyHTGVXHLCKKMDID-UHFFFAOYSA-N
XLogP-1.73
TPSA103.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.16
LogP ≤ 5-1.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-sulfamoylprop-2-enamide?
The IUPAC name of 3-sulfamoylprop-2-enamide (CID 142050789) is 3-sulfamoylprop-2-enamide.
What is the SMILES notation for 3-sulfamoylprop-2-enamide?
The canonical SMILES for 3-sulfamoylprop-2-enamide is NC(=O)C=CS(N)(=O)=O.
What is the InChIKey of 3-sulfamoylprop-2-enamide?
The InChIKey is HTGVXHLCKKMDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2O3S/c4-3(6)1-2-9(5,7)8/h1-2H,(H2,4,6)(H2,5,7,8).
What are the key properties of 3-sulfamoylprop-2-enamide?
3-sulfamoylprop-2-enamide has a molecular weight of 150.16 g/mol, XLogP of -1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-sulfamoylprop-2-enamide is sourced from PubChem (CID 142050789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).