N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide

C20H24N2O3S — CID 19062446

IUPACN-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC3CCCC3)c2C)cc1
InChIInChI=1S/C20H24N2O3S/c1-14-10-12-17(13-11-14)26(24,25)22-19-9-5-8-18(15(19)2)20(23)21-16-6-3-4-7-16/h5,8-13,16,22H,3-4,6-7H2,1-2H3,(H,21,23)
InChIKeyDVSHWLLCJLWDFP-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.78
Rot. Bonds5

About N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide

N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 19062446) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID19062446
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC3CCCC3)c2C)cc1
InChIInChI=1S/C20H24N2O3S/c1-14-10-12-17(13-11-14)26(24,25)22-19-9-5-8-18(15(19)2)20(23)21-16-6-3-4-7-16/h5,8-13,16,22H,3-4,6-7H2,1-2H3,(H,21,23)
InChIKeyDVSHWLLCJLWDFP-UHFFFAOYSA-N
XLogP3.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzenesulfonamido)-N-cycloheptylbenzamide
CID 126412627
N-(2,6-dimethylphenyl)-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 19062451
methyl 4-[[2-(cyclopentylcarbamoyl)phenyl]sulfamoyl]benzoate
CID 17496883
N-[2-methyl-3-[(4-methylphenyl)sulfonylamino]phenyl]cyclopentanecarboxamide
CID 169370677
4-[(3-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
CID 109058337
N-cycloheptyl-2-methyl-5-[(2-methylphenyl)sulfamoyl]benzamide
CID 25342365
N-cyclopentyl-3-hydroxy-2-methylbenzamide
CID 82786265
4-methyl-N-[2-methyl-3-[(3S)-3-methylpiperidine-1-carbonyl]phenyl]benzenesulfonamide
CID 41368483
N-cyclohexyl-2-methyl-5-[(4-methylphenyl)sulfamoyl]benzamide
CID 26534981
4-[(2,3-dimethylphenyl)sulfamoyl]-N-piperidin-4-ylbenzamide
CID 119388218
2-methyl-3-[(4-methylphenyl)sulfonylamino]-N-(4-piperidin-1-ylphenyl)benzamide
CID 100512380
methyl 2-[4-[[2-(cyclopropylcarbamoyl)phenyl]sulfamoyl]phenoxy]acetate
CID 17234061

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide (CID 19062446) is N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide is Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC3CCCC3)c2C)cc1.
What is the InChIKey of N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is DVSHWLLCJLWDFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-14-10-12-17(13-11-14)26(24,25)22-19-9-5-8-18(15(19)2)20(23)21-16-6-3-4-7-16/h5,8-13,16,22H,3-4,6-7H2,1-2H3,(H,21,23).
What are the key properties of N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide?
N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 372.49 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 19062446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).