4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide

C13H17ClN2O3S — CID 9213864

IUPAC4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1Cl
InChIInChI=1S/C13H17ClN2O3S/c1-15-20(18,19)12-8-9(6-7-11(12)14)13(17)16-10-4-2-3-5-10/h6-8,10,15H,2-5H2,1H3,(H,16,17)
InChIKeyLTJYXAJMTULKGI-UHFFFAOYSA-N
MW316.81 g/mol
LogP1.92
Rot. Bonds4

About 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide

4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide (PubChem CID 9213864) has the molecular formula C13H17ClN2O3S and a molecular weight of 316.81 g/mol. Its IUPAC name is 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide
PubChem CID9213864
Molecular FormulaC13H17ClN2O3S
Molecular Weight316.81 g/mol
Exact Mass316.06
IUPAC Name4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1Cl
InChIInChI=1S/C13H17ClN2O3S/c1-15-20(18,19)12-8-9(6-7-11(12)14)13(17)16-10-4-2-3-5-10/h6-8,10,15H,2-5H2,1H3,(H,16,17)
InChIKeyLTJYXAJMTULKGI-UHFFFAOYSA-N
XLogP1.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.81
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-cyclopropyl-3-(methylsulfamoyl)benzamide
CID 9165471
4-chloro-N-cyclohexyl-3-methylsulfonylbenzamide
CID 17456227
4-chloro-3-[(2-chlorophenyl)sulfamoyl]-N-cyclopentylbenzamide
CID 9214869
3-(azepan-1-ylsulfonyl)-4-chloro-N-cyclohexylbenzamide
CID 1216844
4-chloro-N-cyclohexyl-3-piperidin-1-ylsulfonylbenzamide
CID 1068470
4-chloro-N-methyl-3-(methylsulfamoyl)benzamide
CID 19394
4-chloro-N-cyclooctyl-3-[methoxy(methyl)sulfamoyl]benzamide
CID 26244416
2-chloro-N-cyclopentyl-5-(methylsulfamoyl)benzamide
CID 9214313
4-chloro-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]-3-(methylsulfamoyl)benzamide
CID 9473011
methyl 4-chloro-3-(cyclopentylsulfamoyl)benzoate
CID 35294285
3-bromo-4-chloro-N-cycloheptylbenzamide
CID 107999241
4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide
CID 43000186

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide?
The IUPAC name of 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide (CID 9213864) is 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide.
What is the SMILES notation for 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide?
The canonical SMILES for 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1Cl.
What is the InChIKey of 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide?
The InChIKey is LTJYXAJMTULKGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O3S/c1-15-20(18,19)12-8-9(6-7-11(12)14)13(17)16-10-4-2-3-5-10/h6-8,10,15H,2-5H2,1H3,(H,16,17).
What are the key properties of 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide?
4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide has a molecular weight of 316.81 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide is sourced from PubChem (CID 9213864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).