5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide

C14H15ClN2O3S2 — CID 9219442

IUPAC5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C14H15ClN2O3S2/c1-9(2)17-22(19,20)11-5-3-10(4-6-11)16-14(18)12-7-8-13(15)21-12/h3-9,17H,1-2H3,(H,16,18)
InChIKeyMBVFKJGESIURAC-UHFFFAOYSA-N
MW358.87 g/mol
LogP3.34
Rot. Bonds5

About 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide

5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 9219442) has the molecular formula C14H15ClN2O3S2 and a molecular weight of 358.87 g/mol. Its IUPAC name is 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
PubChem CID9219442
Molecular FormulaC14H15ClN2O3S2
Molecular Weight358.87 g/mol
Exact Mass358.02
IUPAC Name5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C14H15ClN2O3S2/c1-9(2)17-22(19,20)11-5-3-10(4-6-11)16-14(18)12-7-8-13(15)21-12/h3-9,17H,1-2H3,(H,16,18)
InChIKeyMBVFKJGESIURAC-UHFFFAOYSA-N
XLogP3.34
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[4-(methylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 4802431
4-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 4924513
5-chloro-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 9343844
N-(4-acetamidophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 27648936
4-[(5-chlorothiophene-2-carbonyl)amino]benzoic acid
CID 43091739
[1-oxo-1-[4-(propan-2-ylsulfamoyl)anilino]propan-2-yl] 5-methylthiophene-2-carboxylate
CID 55318696
2-amino-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119269225
2,2-diphenyl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 1263402
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 25400706
2-methyl-N-[4-(propan-2-ylsulfamoyl)phenyl]prop-2-enamide
CID 18668315
2,2-dimethyl-N-[4-(propan-2-ylsulfamoyl)phenyl]butanamide
CID 58611685
N-[4-(propan-2-ylsulfamoyl)phenyl]-1H-pyrazole-4-carboxamide
CID 61260747

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide (CID 9219442) is 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide is CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)s2)cc1.
What is the InChIKey of 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is MBVFKJGESIURAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O3S2/c1-9(2)17-22(19,20)11-5-3-10(4-6-11)16-14(18)12-7-8-13(15)21-12/h3-9,17H,1-2H3,(H,16,18).
What are the key properties of 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide has a molecular weight of 358.87 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 9219442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).