3-(benzenesulfonamido)-N-cyclopropylbenzamide

C16H16N2O3S — CID 17465618

IUPAC3-(benzenesulfonamido)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O3S/c19-16(17-13-9-10-13)12-5-4-6-14(11-12)18-22(20,21)15-7-2-1-3-8-15/h1-8,11,13,18H,9-10H2,(H,17,19)
InChIKeyKAIFUSWTPSZVII-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.38
Rot. Bonds5

About 3-(benzenesulfonamido)-N-cyclopropylbenzamide

3-(benzenesulfonamido)-N-cyclopropylbenzamide (PubChem CID 17465618) has the molecular formula C16H16N2O3S and a molecular weight of 316.38 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-cyclopropylbenzamide
PubChem CID17465618
Molecular FormulaC16H16N2O3S
Molecular Weight316.38 g/mol
Exact Mass316.09
IUPAC Name3-(benzenesulfonamido)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O3S/c19-16(17-13-9-10-13)12-5-4-6-14(11-12)18-22(20,21)15-7-2-1-3-8-15/h1-8,11,13,18H,9-10H2,(H,17,19)
InChIKeyKAIFUSWTPSZVII-UHFFFAOYSA-N
XLogP2.38
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1S,3R)-3-[[3-(benzenesulfonamido)benzoyl]amino]cyclopentane-1-carboxylic acid
CID 120674975
N-cyclopropyl-3-[(4-cyclopropylphenyl)sulfonylamino]benzamide
CID 167833629
N-cyclopropyl-3-[(3-methoxyphenyl)sulfamoyl]benzamide
CID 109062340
3-[(3-chlorophenyl)sulfamoyl]-N-cyclohexylbenzamide
CID 9043246
N-(4-aminocyclohexyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 119474947
4-(benzenesulfonamido)-N-cyclooctylbenzamide
CID 24635133
N-(4-aminocyclohexyl)-3-[(3-methylphenyl)sulfamoyl]benzamide;hydrochloride
CID 119474946
3-(benzenesulfonamido)-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)benzamide
CID 126783508
N-cyclopropyl-3-[(3,4-dimethoxyphenyl)sulfamoyl]benzamide
CID 109062347
3-[[3-(cyclopropylcarbamoyl)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid
CID 22109123
N-cyclopropyl-3-[(2-nitrophenyl)sulfonylamino]benzamide
CID 40688024
N-cyclopropyl-3-[(2,5-dibromophenyl)sulfonylamino]benzamide
CID 26489644

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N-cyclopropylbenzamide?
The IUPAC name of 3-(benzenesulfonamido)-N-cyclopropylbenzamide (CID 17465618) is 3-(benzenesulfonamido)-N-cyclopropylbenzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-cyclopropylbenzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-cyclopropylbenzamide is O=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N-cyclopropylbenzamide?
The InChIKey is KAIFUSWTPSZVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3S/c19-16(17-13-9-10-13)12-5-4-6-14(11-12)18-22(20,21)15-7-2-1-3-8-15/h1-8,11,13,18H,9-10H2,(H,17,19).
What are the key properties of 3-(benzenesulfonamido)-N-cyclopropylbenzamide?
3-(benzenesulfonamido)-N-cyclopropylbenzamide has a molecular weight of 316.38 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-cyclopropylbenzamide is sourced from PubChem (CID 17465618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).