1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide

C15H22ClNO3S — CID 56764329

IUPAC1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1)NCC(O)C1CCCCC1
InChIInChI=1S/C15H22ClNO3S/c16-14-8-6-12(7-9-14)11-21(19,20)17-10-15(18)13-4-2-1-3-5-13/h6-9,13,15,17-18H,1-5,10-11H2
InChIKeyWHLUAZRNDPTVEF-UHFFFAOYSA-N
MW331.86 g/mol
LogP2.70
Rot. Bonds6

About 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide

1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide (PubChem CID 56764329) has the molecular formula C15H22ClNO3S and a molecular weight of 331.86 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide
PubChem CID56764329
Molecular FormulaC15H22ClNO3S
Molecular Weight331.86 g/mol
Exact Mass331.10
IUPAC Name1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1)NCC(O)C1CCCCC1
InChIInChI=1S/C15H22ClNO3S/c16-14-8-6-12(7-9-14)11-21(19,20)17-10-15(18)13-4-2-1-3-5-13/h6-9,13,15,17-18H,1-5,10-11H2
InChIKeyWHLUAZRNDPTVEF-UHFFFAOYSA-N
XLogP2.70
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.86
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide (CID 56764329) is 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide is O=S(=O)(Cc1ccc(Cl)cc1)NCC(O)C1CCCCC1.
What is the InChIKey of 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide?
The InChIKey is WHLUAZRNDPTVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO3S/c16-14-8-6-12(7-9-14)11-21(19,20)17-10-15(18)13-4-2-1-3-5-13/h6-9,13,15,17-18H,1-5,10-11H2.
What are the key properties of 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide?
1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide has a molecular weight of 331.86 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(2-cyclohexyl-2-hydroxyethyl)methanesulfonamide is sourced from PubChem (CID 56764329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).