4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide

C13H14N2O3S2 — CID 6486034

IUPAC4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCc1cccc(N(C)S(=O)(=O)c2csc(C(N)=O)c2)c1
InChIInChI=1S/C13H14N2O3S2/c1-9-4-3-5-10(6-9)15(2)20(17,18)11-7-12(13(14)16)19-8-11/h3-8H,1-2H3,(H2,14,16)
InChIKeyUNBPTQRFLCSSFX-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.98
Rot. Bonds4

About 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide

4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide (PubChem CID 6486034) has the molecular formula C13H14N2O3S2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
PubChem CID6486034
Molecular FormulaC13H14N2O3S2
Molecular Weight310.40 g/mol
Exact Mass310.04
IUPAC Name4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCc1cccc(N(C)S(=O)(=O)c2csc(C(N)=O)c2)c1
InChIInChI=1S/C13H14N2O3S2/c1-9-4-3-5-10(6-9)15(2)20(17,18)11-7-12(13(14)16)19-8-11/h3-8H,1-2H3,(H2,14,16)
InChIKeyUNBPTQRFLCSSFX-UHFFFAOYSA-N
XLogP1.98
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide 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 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The IUPAC name of 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide (CID 6486034) is 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The canonical SMILES for 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide is Cc1cccc(N(C)S(=O)(=O)c2csc(C(N)=O)c2)c1.
What is the InChIKey of 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The InChIKey is UNBPTQRFLCSSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S2/c1-9-4-3-5-10(6-9)15(2)20(17,18)11-7-12(13(14)16)19-8-11/h3-8H,1-2H3,(H2,14,16).
What are the key properties of 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl-(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 6486034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).