4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide

C19H23NO2S — CID 789353

IUPAC4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C19H23NO2S/c1-15-7-5-6-10-19(15)20-23(21,22)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h5-7,10-14,16,20H,2-4,8-9H2,1H3
InChIKeySTLMNZVBCJVQOZ-UHFFFAOYSA-N
MW329.47 g/mol
LogP4.84
Rot. Bonds4

About 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide

4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide (PubChem CID 789353) has the molecular formula C19H23NO2S and a molecular weight of 329.47 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide
PubChem CID789353
Molecular FormulaC19H23NO2S
Molecular Weight329.47 g/mol
Exact Mass329.14
IUPAC Name4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C19H23NO2S/c1-15-7-5-6-10-19(15)20-23(21,22)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h5-7,10-14,16,20H,2-4,8-9H2,1H3
InChIKeySTLMNZVBCJVQOZ-UHFFFAOYSA-N
XLogP4.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide?
The IUPAC name of 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide (CID 789353) is 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide?
The canonical SMILES for 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide is Cc1ccccc1NS(=O)(=O)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide?
The InChIKey is STLMNZVBCJVQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2S/c1-15-7-5-6-10-19(15)20-23(21,22)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h5-7,10-14,16,20H,2-4,8-9H2,1H3.
What are the key properties of 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide?
4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide has a molecular weight of 329.47 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 789353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).