5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide

C13H14N2O3S2 — CID 1247495

IUPAC5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide
SMILESCNS(=O)(=O)c1ccc(NC(=O)c2csc(C)c2)cc1
InChIInChI=1S/C13H14N2O3S2/c1-9-7-10(8-19-9)13(16)15-11-3-5-12(6-4-11)20(17,18)14-2/h3-8,14H,1-2H3,(H,15,16)
InChIKeyWNPLVRXOTIHBCB-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.22
Rot. Bonds4

About 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide

5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide (PubChem CID 1247495) has the molecular formula C13H14N2O3S2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide
PubChem CID1247495
Molecular FormulaC13H14N2O3S2
Molecular Weight310.40 g/mol
Exact Mass310.04
IUPAC Name5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide
SMILESCNS(=O)(=O)c1ccc(NC(=O)c2csc(C)c2)cc1
InChIInChI=1S/C13H14N2O3S2/c1-9-7-10(8-19-9)13(16)15-11-3-5-12(6-4-11)20(17,18)14-2/h3-8,14H,1-2H3,(H,15,16)
InChIKeyWNPLVRXOTIHBCB-UHFFFAOYSA-N
XLogP2.22
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-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 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide?
The IUPAC name of 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide (CID 1247495) is 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide is CNS(=O)(=O)c1ccc(NC(=O)c2csc(C)c2)cc1.
What is the InChIKey of 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide?
The InChIKey is WNPLVRXOTIHBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S2/c1-9-7-10(8-19-9)13(16)15-11-3-5-12(6-4-11)20(17,18)14-2/h3-8,14H,1-2H3,(H,15,16).
What are the key properties of 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide?
5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide is sourced from PubChem (CID 1247495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).