N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide

C20H23ClN2O3S — CID 46671519

IUPACN-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide
SMILESCC(NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1cccc(Cl)c1
InChIInChI=1S/C20H23ClN2O3S/c1-14(15-6-4-8-17(21)12-15)22-20(24)16-7-5-11-19(13-16)27(25,26)23-18-9-2-3-10-18/h4-8,11-14,18,23H,2-3,9-10H2,1H3,(H,22,24)
InChIKeyUUKTZQDWSWDCOJ-UHFFFAOYSA-N
MW406.94 g/mol
LogP4.05
Rot. Bonds6

About N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide

N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide (PubChem CID 46671519) has the molecular formula C20H23ClN2O3S and a molecular weight of 406.94 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide
PubChem CID46671519
Molecular FormulaC20H23ClN2O3S
Molecular Weight406.94 g/mol
Exact Mass406.11
IUPAC NameN-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide
SMILESCC(NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1cccc(Cl)c1
InChIInChI=1S/C20H23ClN2O3S/c1-14(15-6-4-8-17(21)12-15)22-20(24)16-7-5-11-19(13-16)27(25,26)23-18-9-2-3-10-18/h4-8,11-14,18,23H,2-3,9-10H2,1H3,(H,22,24)
InChIKeyUUKTZQDWSWDCOJ-UHFFFAOYSA-N
XLogP4.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.94
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-chlorophenyl)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 134045491
N-(1-amino-4-methylpentan-2-yl)-3-(cyclopentylsulfamoyl)benzamide
CID 119585530
2-[[3-(cyclopentylsulfamoyl)benzoyl]amino]butanoic acid
CID 119223890
3-(cyclohexylsulfamoyl)-N-cyclopentylbenzamide
CID 109063195
N-[(1R)-1-(3-chlorophenyl)ethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 7944643
N-[(1S)-1-(3-chlorophenyl)ethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 7944640
3-(cyclopentylsulfamoyl)-N-ethylbenzamide
CID 30830540
3-[[(5-chloro-2-hydroxybenzoyl)amino]carbamoyl]-N-cyclopentylbenzenesulfonamide
CID 55585755
3-(cyclopropylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
CID 46570374
3-(1-aminoethyl)-N-cyclopentylbenzenesulfonamide
CID 43101815
3-(cyclopentylsulfamoyl)-N-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]benzamide
CID 55588486
3-(cyclopentylsulfamoyl)-N-(2-hydroxyethyl)benzamide
CID 78854342

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide?
The IUPAC name of N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide (CID 46671519) is N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide?
The canonical SMILES for N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide is CC(NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1cccc(Cl)c1.
What is the InChIKey of N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide?
The InChIKey is UUKTZQDWSWDCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O3S/c1-14(15-6-4-8-17(21)12-15)22-20(24)16-7-5-11-19(13-16)27(25,26)23-18-9-2-3-10-18/h4-8,11-14,18,23H,2-3,9-10H2,1H3,(H,22,24).
What are the key properties of N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide?
N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide has a molecular weight of 406.94 g/mol, XLogP of 4.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)ethyl]-3-(cyclopentylsulfamoyl)benzamide is sourced from PubChem (CID 46671519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).