3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide

C19H21ClN2O3S — CID 109063245

IUPAC3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide
SMILESCc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H21ClN2O3S/c1-13-9-10-15(20)12-18(13)22-26(24,25)17-8-4-5-14(11-17)19(23)21-16-6-2-3-7-16/h4-5,8-12,16,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyDIQONDVMQSBXQM-UHFFFAOYSA-N
MW392.91 g/mol
LogP4.12
Rot. Bonds5

About 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide

3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide (PubChem CID 109063245) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide.

Molecular Properties

Compound Name3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide
PubChem CID109063245
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC Name3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide
SMILESCc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H21ClN2O3S/c1-13-9-10-15(20)12-18(13)22-26(24,25)17-8-4-5-14(11-17)19(23)21-16-6-2-3-7-16/h4-5,8-12,16,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyDIQONDVMQSBXQM-UHFFFAOYSA-N
XLogP4.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-chloro-2-methylphenyl)sulfamoyl]benzoic acid
CID 8504645
N-(5-chloro-2-methylphenyl)-3-(hydrazinecarbonyl)benzenesulfonamide
CID 100657069
4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
CID 109058338
3-[(2-chlorophenyl)sulfamoyl]-N-cyclopentylbenzamide
CID 9214750
3-acetyl-N-(5-chloro-2-methylphenyl)benzenesulfonamide
CID 8504652
3-[(3-chlorophenyl)sulfamoyl]-N-cyclohexylbenzamide
CID 9043246
3-(benzenesulfonamido)-N-cyclooctyl-4-methylbenzamide
CID 19062588
3-(benzenesulfonamido)-N-cycloheptyl-4-methylbenzamide
CID 19062561
N-cyclopentyl-3-[(2,3,4-trifluorophenyl)sulfamoyl]benzamide
CID 109063262
N-butyl-3-[(5-chloro-2-methylphenyl)sulfamoyl]benzamide
CID 109062606
N-(5-chloro-2-methylphenyl)-3-(piperidine-1-carbonyl)benzenesulfonamide
CID 109063322
1-N-(5-chloro-2-methylphenyl)-3-N-cyclopropylbenzene-1,3-dicarboxamide
CID 109050783

Frequently Asked Questions

What is the IUPAC name of 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide?
The IUPAC name of 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide (CID 109063245) is 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide.
What is the SMILES notation for 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide?
The canonical SMILES for 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide is Cc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NC2CCCC2)c1.
What is the InChIKey of 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide?
The InChIKey is DIQONDVMQSBXQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c1-13-9-10-15(20)12-18(13)22-26(24,25)17-8-4-5-14(11-17)19(23)21-16-6-2-3-7-16/h4-5,8-12,16,22H,2-3,6-7H2,1H3,(H,21,23).
What are the key properties of 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide?
3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide has a molecular weight of 392.91 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide is sourced from PubChem (CID 109063245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).