4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide

C13H14N2O4S2 — CID 6503906

IUPAC4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cs1
InChIInChI=1S/C13H14N2O4S2/c1-14-13(16)12-7-11(8-20-12)21(17,18)15-9-3-5-10(19-2)6-4-9/h3-8,15H,1-2H3,(H,14,16)
InChIKeyMXFABMRUFBKNOI-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.92
Rot. Bonds5

About 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide

4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide (PubChem CID 6503906) has the molecular formula C13H14N2O4S2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
PubChem CID6503906
Molecular FormulaC13H14N2O4S2
Molecular Weight326.40 g/mol
Exact Mass326.04
IUPAC Name4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cs1
InChIInChI=1S/C13H14N2O4S2/c1-14-13(16)12-7-11(8-20-12)21(17,18)15-9-3-5-10(19-2)6-4-9/h3-8,15H,1-2H3,(H,14,16)
InChIKeyMXFABMRUFBKNOI-UHFFFAOYSA-N
XLogP1.92
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide?
The IUPAC name of 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide (CID 6503906) is 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide.
What is the SMILES notation for 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide?
The canonical SMILES for 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide is CNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cs1.
What is the InChIKey of 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide?
The InChIKey is MXFABMRUFBKNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S2/c1-14-13(16)12-7-11(8-20-12)21(17,18)15-9-3-5-10(19-2)6-4-9/h3-8,15H,1-2H3,(H,14,16).
What are the key properties of 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide?
4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 6503906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).