1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide

C6H12N4O4S2 — CID 62063368

IUPAC1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NCCS(N)(=O)=O)cn1
InChIInChI=1S/C6H12N4O4S2/c1-10-5-6(4-8-10)16(13,14)9-2-3-15(7,11)12/h4-5,9H,2-3H2,1H3,(H2,7,11,12)
InChIKeyQURBICUXCIHDMW-UHFFFAOYSA-N
MW268.32 g/mol
LogP-2.01
Rot. Bonds5

About 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide

1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide (PubChem CID 62063368) has the molecular formula C6H12N4O4S2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide
PubChem CID62063368
Molecular FormulaC6H12N4O4S2
Molecular Weight268.32 g/mol
Exact Mass268.03
IUPAC Name1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NCCS(N)(=O)=O)cn1
InChIInChI=1S/C6H12N4O4S2/c1-10-5-6(4-8-10)16(13,14)9-2-3-15(7,11)12/h4-5,9H,2-3H2,1H3,(H2,7,11,12)
InChIKeyQURBICUXCIHDMW-UHFFFAOYSA-N
XLogP-2.01
TPSA124.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-2.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1-methylpyrazol-4-yl)sulfonylamino]ethanesulfonyl chloride
CID 81358188
N-(2-chloroethyl)-1-methylpyrazole-4-sulfonamide
CID 62062630
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-methylpyrazole-4-sulfonamide
CID 113285935
N-(6-chlorohexyl)-1-methylpyrazole-4-sulfonamide
CID 107849199
N-(5-iodopentyl)-1-methylpyrazole-4-sulfonamide
CID 107322883
N-(3-chlorobutyl)-1-methylpyrazole-4-sulfonamide
CID 65032541
4-[(1-methylpyrazol-4-yl)sulfonylamino]butanoic acid
CID 43361171
5-[(1-methylpyrazol-4-yl)sulfonylamino]pentanoic acid
CID 62033979
N-[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]ethyl]-1-methylpyrazole-4-sulfonamide
CID 94025310
N-[2-(2-hydroxyethoxy)ethyl]-1-methylpyrazole-4-sulfonamide
CID 62498133
N-(2-chloropropyl)-1-methylpyrazole-4-sulfonamide
CID 65033783
N-[(2-bromophenyl)methyl]-1-methylpyrazole-4-sulfonamide
CID 62049706

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide?
The IUPAC name of 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide (CID 62063368) is 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide.
What is the SMILES notation for 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide?
The canonical SMILES for 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide is Cn1cc(S(=O)(=O)NCCS(N)(=O)=O)cn1.
What is the InChIKey of 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide?
The InChIKey is QURBICUXCIHDMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O4S2/c1-10-5-6(4-8-10)16(13,14)9-2-3-15(7,11)12/h4-5,9H,2-3H2,1H3,(H2,7,11,12).
What are the key properties of 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide?
1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide has a molecular weight of 268.32 g/mol, XLogP of -2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 62063368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).