3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide

C21H25ClN2O3S — CID 25471701

IUPAC3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide
SMILESCN(C(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1)C1CCCCC1
InChIInChI=1S/C21H25ClN2O3S/c1-24(18-10-6-3-7-11-18)21(25)17-12-13-19(22)20(14-17)28(26,27)23-15-16-8-4-2-5-9-16/h2,4-5,8-9,12-14,18,23H,3,6-7,10-11,15H2,1H3
InChIKeyMPZFKXRDZRLIJD-UHFFFAOYSA-N
MW420.96 g/mol
LogP4.22
Rot. Bonds6

About 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide

3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide (PubChem CID 25471701) has the molecular formula C21H25ClN2O3S and a molecular weight of 420.96 g/mol. Its IUPAC name is 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide.

Molecular Properties

Compound Name3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide
PubChem CID25471701
Molecular FormulaC21H25ClN2O3S
Molecular Weight420.96 g/mol
Exact Mass420.13
IUPAC Name3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide
SMILESCN(C(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1)C1CCCCC1
InChIInChI=1S/C21H25ClN2O3S/c1-24(18-10-6-3-7-11-18)21(25)17-12-13-19(22)20(14-17)28(26,27)23-15-16-8-4-2-5-9-16/h2,4-5,8-9,12-14,18,23H,3,6-7,10-11,15H2,1H3
InChIKeyMPZFKXRDZRLIJD-UHFFFAOYSA-N
XLogP4.22
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.96
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(cyclohexylamino)-2-oxoethyl] 3-(benzylsulfamoyl)-4-chlorobenzoate
CID 2599580
3-(benzylsulfamoyl)-N-[2-(tert-butylamino)-2-oxoethyl]-4-chloro-N-methylbenzamide
CID 24550044
5-(azepane-1-carbonyl)-N-benzyl-2-chlorobenzenesulfonamide
CID 9314912
4-chloro-N-cyclohexyl-N-methyl-3-piperidin-1-ylsulfonylbenzamide
CID 27670624
N-benzyl-5-(2-bromoacetyl)-2-chlorobenzenesulfonamide
CID 21316702
3-(benzylsulfamoyl)-4-chloro-N-methoxybenzamide
CID 52563097
N-[2-(benzylamino)-2-oxoethyl]-3-(benzylsulfamoyl)-4-chlorobenzamide
CID 38639374
3-(benzylsulfamoyl)-4-chloro-N-[2-(2-fluorophenoxy)ethyl]-N-methylbenzamide
CID 24552174
3-chloro-N-cycloheptyl-4-iodo-N-methylbenzamide
CID 103221242
3-(benzylsulfamoyl)-4-chloro-N-(3-phenylprop-2-ynyl)benzamide
CID 24615553
3-(benzylsulfamoyl)-4-chloro-N-(3-ethoxypropyl)benzamide
CID 24540711
3-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 27670732

Frequently Asked Questions

What is the IUPAC name of 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide?
The IUPAC name of 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide (CID 25471701) is 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide.
What is the SMILES notation for 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide?
The canonical SMILES for 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide is CN(C(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1)C1CCCCC1.
What is the InChIKey of 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide?
The InChIKey is MPZFKXRDZRLIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25ClN2O3S/c1-24(18-10-6-3-7-11-18)21(25)17-12-13-19(22)20(14-17)28(26,27)23-15-16-8-4-2-5-9-16/h2,4-5,8-9,12-14,18,23H,3,6-7,10-11,15H2,1H3.
What are the key properties of 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide?
3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide has a molecular weight of 420.96 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzylsulfamoyl)-4-chloro-N-cyclohexyl-N-methylbenzamide is sourced from PubChem (CID 25471701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).