5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide

C19H21ClN2O4S — CID 47087643

IUPAC5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(Cl)cc1C(=O)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C19H21ClN2O4S/c1-27(24,25)22-18-10-9-13(20)11-17(18)19(23)21-14-5-4-8-16(12-14)26-15-6-2-3-7-15/h4-5,8-12,15,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyAFLKOUOMLIHOAY-UHFFFAOYSA-N
MW408.91 g/mol
LogP4.29
Rot. Bonds6

About 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide

5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide (PubChem CID 47087643) has the molecular formula C19H21ClN2O4S and a molecular weight of 408.91 g/mol. Its IUPAC name is 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide.

Molecular Properties

Compound Name5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide
PubChem CID47087643
Molecular FormulaC19H21ClN2O4S
Molecular Weight408.91 g/mol
Exact Mass408.09
IUPAC Name5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(Cl)cc1C(=O)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C19H21ClN2O4S/c1-27(24,25)22-18-10-9-13(20)11-17(18)19(23)21-14-5-4-8-16(12-14)26-15-6-2-3-7-15/h4-5,8-12,15,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyAFLKOUOMLIHOAY-UHFFFAOYSA-N
XLogP4.29
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.91
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide
CID 49191937
5-chloro-N-(3-ethylphenyl)-2-(methanesulfonamido)benzamide
CID 60606334
5-chloro-N-(cyclobutylmethyl)-2-(methanesulfonamido)benzamide
CID 49194436
2-chloro-N-(3-cyclopentyloxyphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 55563879
2,4-dichloro-N-[4-(methanesulfonamido)-3-methoxyphenyl]benzamide
CID 37258917
5-chloro-2-fluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]benzamide
CID 25487071
N-(3-cyclopentyloxyphenyl)-5-methylfuran-2-carboxamide
CID 690631
N-(2-acetyl-4-chlorophenyl)methanesulfonamide
CID 145014745
6-chloro-N-(3-cyclopentyloxyphenyl)pyridine-3-carboxamide
CID 46579918
5-acetamido-N-[3-(cyclopropanecarbonylamino)phenyl]-2-(methanesulfonamido)benzamide
CID 56515740
N-(3-cyclopentyloxyphenyl)-5-(diethylsulfamoyl)-2-methoxybenzamide
CID 38859591
5-acetamido-2-(methanesulfonamido)-N-(3-pyrrolidin-1-ylphenyl)benzamide
CID 56579334

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide?
The IUPAC name of 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide (CID 47087643) is 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide.
What is the SMILES notation for 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide?
The canonical SMILES for 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide is CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)Nc1cccc(OC2CCCC2)c1.
What is the InChIKey of 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide?
The InChIKey is AFLKOUOMLIHOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4S/c1-27(24,25)22-18-10-9-13(20)11-17(18)19(23)21-14-5-4-8-16(12-14)26-15-6-2-3-7-15/h4-5,8-12,15,22H,2-3,6-7H2,1H3,(H,21,23).
What are the key properties of 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide?
5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide has a molecular weight of 408.91 g/mol, XLogP of 4.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide is sourced from PubChem (CID 47087643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).