N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide

C11H10ClNO2S2 — CID 2275298

IUPACN-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cccs2)cc1Cl
InChIInChI=1S/C11H10ClNO2S2/c1-8-4-5-9(7-10(8)12)13-17(14,15)11-3-2-6-16-11/h2-7,13H,1H3
InChIKeyKOTPGHDHHVOARW-UHFFFAOYSA-N
MW287.79 g/mol
LogP3.51
Rot. Bonds3

About N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide

N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide (PubChem CID 2275298) has the molecular formula C11H10ClNO2S2 and a molecular weight of 287.79 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide
PubChem CID2275298
Molecular FormulaC11H10ClNO2S2
Molecular Weight287.79 g/mol
Exact Mass286.98
IUPAC NameN-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cccs2)cc1Cl
InChIInChI=1S/C11H10ClNO2S2/c1-8-4-5-9(7-10(8)12)13-17(14,15)11-3-2-6-16-11/h2-7,13H,1H3
InChIKeyKOTPGHDHHVOARW-UHFFFAOYSA-N
XLogP3.51
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.79
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide 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 N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide (CID 2275298) is N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide is Cc1ccc(NS(=O)(=O)c2cccs2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide?
The InChIKey is KOTPGHDHHVOARW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO2S2/c1-8-4-5-9(7-10(8)12)13-17(14,15)11-3-2-6-16-11/h2-7,13H,1H3.
What are the key properties of N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide?
N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide has a molecular weight of 287.79 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 2275298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).