5-methyl-1H-pyrazole-4-sulfonamide

C4H7N3O2S — CID 60911472

IUPAC5-methyl-1H-pyrazole-4-sulfonamide
SMILESCc1[nH]ncc1S(N)(=O)=O
InChIInChI=1S/C4H7N3O2S/c1-3-4(2-6-7-3)10(5,8)9/h2H,1H3,(H,6,7)(H2,5,8,9)
InChIKeyMIMXTAARSXTZJH-UHFFFAOYSA-N
MW161.19 g/mol
LogP-0.63
Rot. Bonds1

About 5-methyl-1H-pyrazole-4-sulfonamide

5-methyl-1H-pyrazole-4-sulfonamide (PubChem CID 60911472) has the molecular formula C4H7N3O2S and a molecular weight of 161.19 g/mol. Its IUPAC name is 5-methyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-methyl-1H-pyrazole-4-sulfonamide
PubChem CID60911472
Molecular FormulaC4H7N3O2S
Molecular Weight161.19 g/mol
Exact Mass161.03
IUPAC Name5-methyl-1H-pyrazole-4-sulfonamide
SMILESCc1[nH]ncc1S(N)(=O)=O
InChIInChI=1S/C4H7N3O2S/c1-3-4(2-6-7-3)10(5,8)9/h2H,1H3,(H,6,7)(H2,5,8,9)
InChIKeyMIMXTAARSXTZJH-UHFFFAOYSA-N
XLogP-0.63
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.19
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-methyl-1H-pyrazole-4-sulfonamide (CID 60911472) is 5-methyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-methyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-methyl-1H-pyrazole-4-sulfonamide is Cc1[nH]ncc1S(N)(=O)=O.
What is the InChIKey of 5-methyl-1H-pyrazole-4-sulfonamide?
The InChIKey is MIMXTAARSXTZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O2S/c1-3-4(2-6-7-3)10(5,8)9/h2H,1H3,(H,6,7)(H2,5,8,9).
What are the key properties of 5-methyl-1H-pyrazole-4-sulfonamide?
5-methyl-1H-pyrazole-4-sulfonamide has a molecular weight of 161.19 g/mol, XLogP of -0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60911472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).