N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide

C21H25ClN2O4S — CID 55896659

IUPACN-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide
SMILESCCCOc1ccc(Cl)cc1NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C21H25ClN2O4S/c1-2-12-28-20-11-10-16(22)14-19(20)23-21(25)15-6-5-9-18(13-15)29(26,27)24-17-7-3-4-8-17/h5-6,9-11,13-14,17,24H,2-4,7-8,12H2,1H3,(H,23,25)
InChIKeyFJERACOQLUVECL-UHFFFAOYSA-N
MW436.96 g/mol
LogP4.60
Rot. Bonds8

About N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide

N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide (PubChem CID 55896659) has the molecular formula C21H25ClN2O4S and a molecular weight of 436.96 g/mol. Its IUPAC name is N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide
PubChem CID55896659
Molecular FormulaC21H25ClN2O4S
Molecular Weight436.96 g/mol
Exact Mass436.12
IUPAC NameN-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide
SMILESCCCOc1ccc(Cl)cc1NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C21H25ClN2O4S/c1-2-12-28-20-11-10-16(22)14-19(20)23-21(25)15-6-5-9-18(13-15)29(26,27)24-17-7-3-4-8-17/h5-6,9-11,13-14,17,24H,2-4,7-8,12H2,1H3,(H,23,25)
InChIKeyFJERACOQLUVECL-UHFFFAOYSA-N
XLogP4.60
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.96
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-propoxyphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide
CID 55895644
N-(5-chloro-2-fluorophenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 94006212
3-bromo-N-(5-chloro-2-propoxyphenyl)benzamide
CID 63526145
3-(cyclohexylsulfamoyl)-N-(2-ethylphenyl)benzamide
CID 109063388
N-(5-chloro-2-ethoxyphenyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 55981731
3-(cyclopentylsulfamoyl)-N-(2-fluorophenyl)benzamide
CID 109063181
N-(5-chloro-2-methoxyphenyl)-3-(ethylsulfamoyl)benzamide
CID 26582371
N-(5-chloro-2-propoxyphenyl)-4-(ethylsulfamoyl)benzamide
CID 87047072
3-(cyclopentylsulfamoyl)-N-ethylbenzamide
CID 30830540
3-(cyclopropylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide
CID 18189816
N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide
CID 55577445
N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-(cyclopropylsulfamoyl)benzamide
CID 35355750

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide?
The IUPAC name of N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide (CID 55896659) is N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide.
What is the SMILES notation for N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide?
The canonical SMILES for N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide is CCCOc1ccc(Cl)cc1NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide?
The InChIKey is FJERACOQLUVECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25ClN2O4S/c1-2-12-28-20-11-10-16(22)14-19(20)23-21(25)15-6-5-9-18(13-15)29(26,27)24-17-7-3-4-8-17/h5-6,9-11,13-14,17,24H,2-4,7-8,12H2,1H3,(H,23,25).
What are the key properties of N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide?
N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide has a molecular weight of 436.96 g/mol, XLogP of 4.60, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-propoxyphenyl)-3-(cyclopentylsulfamoyl)benzamide is sourced from PubChem (CID 55896659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).