4-methylthiophene-2-sulfonamide

C5H7NO2S2 — CID 600929

IUPAC4-methylthiophene-2-sulfonamide
SMILESCc1csc(S(N)(=O)=O)c1
InChIInChI=1S/C5H7NO2S2/c1-4-2-5(9-3-4)10(6,7)8/h2-3H,1H3,(H2,6,7,8)
InChIKeyZZIZNALHVCSALM-UHFFFAOYSA-N
MW177.25 g/mol
LogP0.70
Rot. Bonds1

About 4-methylthiophene-2-sulfonamide

4-methylthiophene-2-sulfonamide (PubChem CID 600929) has the molecular formula C5H7NO2S2 and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name4-methylthiophene-2-sulfonamide
PubChem CID600929
Molecular FormulaC5H7NO2S2
Molecular Weight177.25 g/mol
Exact Mass176.99
IUPAC Name4-methylthiophene-2-sulfonamide
SMILESCc1csc(S(N)(=O)=O)c1
InChIInChI=1S/C5H7NO2S2/c1-4-2-5(9-3-4)10(6,7)8/h2-3H,1H3,(H2,6,7,8)
InChIKeyZZIZNALHVCSALM-UHFFFAOYSA-N
XLogP0.70
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methylthiophene-2-sulfonamide?
The IUPAC name of 4-methylthiophene-2-sulfonamide (CID 600929) is 4-methylthiophene-2-sulfonamide.
What is the SMILES notation for 4-methylthiophene-2-sulfonamide?
The canonical SMILES for 4-methylthiophene-2-sulfonamide is Cc1csc(S(N)(=O)=O)c1.
What is the InChIKey of 4-methylthiophene-2-sulfonamide?
The InChIKey is ZZIZNALHVCSALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2S2/c1-4-2-5(9-3-4)10(6,7)8/h2-3H,1H3,(H2,6,7,8).
What are the key properties of 4-methylthiophene-2-sulfonamide?
4-methylthiophene-2-sulfonamide has a molecular weight of 177.25 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylthiophene-2-sulfonamide is sourced from PubChem (CID 600929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).