4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide

C17H17ClN2O3S — CID 109058338

IUPAC4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
SMILESCc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C17H17ClN2O3S/c1-11-2-5-13(18)10-16(11)20-24(22,23)15-8-3-12(4-9-15)17(21)19-14-6-7-14/h2-5,8-10,14,20H,6-7H2,1H3,(H,19,21)
InChIKeyDNJQMWMBOVEIPF-UHFFFAOYSA-N
MW364.85 g/mol
LogP3.34
Rot. Bonds5

About 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide

4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide (PubChem CID 109058338) has the molecular formula C17H17ClN2O3S and a molecular weight of 364.85 g/mol. Its IUPAC name is 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
PubChem CID109058338
Molecular FormulaC17H17ClN2O3S
Molecular Weight364.85 g/mol
Exact Mass364.06
IUPAC Name4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
SMILESCc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C17H17ClN2O3S/c1-11-2-5-13(18)10-16(11)20-24(22,23)15-8-3-12(4-9-15)17(21)19-14-6-7-14/h2-5,8-10,14,20H,6-7H2,1H3,(H,19,21)
InChIKeyDNJQMWMBOVEIPF-UHFFFAOYSA-N
XLogP3.34
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.85
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopentylbenzamide
CID 109063245
4-[(3-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
CID 109058337
N-cyclopropyl-4-[(2,6-dimethylphenyl)sulfamoyl]benzamide
CID 109058325
3-(benzenesulfonamido)-N-cyclooctyl-4-methylbenzamide
CID 19062588
3-(benzenesulfonamido)-N-cycloheptyl-4-methylbenzamide
CID 19062561
4-[(5-chloro-2-methylphenyl)carbamoylamino]-N-cyclopropylbenzamide
CID 17180530
4-[(2-chlorophenyl)sulfamoyl]-N-cyclopentylbenzamide
CID 9214488
1-[4-[(5-chloro-2-methylphenyl)sulfamoyl]phenyl]-3-(4-chlorophenyl)urea
CID 2983994
N-(5-chloro-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 2697102
3-[(5-chloro-2-methylphenyl)sulfamoyl]benzoic acid
CID 8504645
N-[4-[[4-[(5-chloro-2-methylphenyl)sulfamoyl]phenyl]sulfamoyl]phenyl]acetamide
CID 1319892
4-[(2-bromophenyl)sulfamoyl]-N-cyclopropylbenzamide
CID 109058368

Frequently Asked Questions

What is the IUPAC name of 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide?
The IUPAC name of 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide (CID 109058338) is 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide.
What is the SMILES notation for 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide?
The canonical SMILES for 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide is Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NC2CC2)cc1.
What is the InChIKey of 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide?
The InChIKey is DNJQMWMBOVEIPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3S/c1-11-2-5-13(18)10-16(11)20-24(22,23)15-8-3-12(4-9-15)17(21)19-14-6-7-14/h2-5,8-10,14,20H,6-7H2,1H3,(H,19,21).
What are the key properties of 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide?
4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide has a molecular weight of 364.85 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide is sourced from PubChem (CID 109058338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).