4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide

C15H23NO3S — CID 2980145

IUPAC4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CCCCC2C)cc1
InChIInChI=1S/C15H23NO3S/c1-3-19-13-8-10-14(11-9-13)20(17,18)16-15-7-5-4-6-12(15)2/h8-12,15-16H,3-7H2,1-2H3
InChIKeyAEOHLSMFZWSNCZ-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.94
Rot. Bonds5

About 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide

4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide (PubChem CID 2980145) has the molecular formula C15H23NO3S and a molecular weight of 297.42 g/mol. Its IUPAC name is 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide
PubChem CID2980145
Molecular FormulaC15H23NO3S
Molecular Weight297.42 g/mol
Exact Mass297.14
IUPAC Name4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CCCCC2C)cc1
InChIInChI=1S/C15H23NO3S/c1-3-19-13-8-10-14(11-9-13)20(17,18)16-15-7-5-4-6-12(15)2/h8-12,15-16H,3-7H2,1-2H3
InChIKeyAEOHLSMFZWSNCZ-UHFFFAOYSA-N
XLogP2.94
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide 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 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide (CID 2980145) is 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide is CCOc1ccc(S(=O)(=O)NC2CCCCC2C)cc1.
What is the InChIKey of 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide?
The InChIKey is AEOHLSMFZWSNCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3S/c1-3-19-13-8-10-14(11-9-13)20(17,18)16-15-7-5-4-6-12(15)2/h8-12,15-16H,3-7H2,1-2H3.
What are the key properties of 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide?
4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-methylcyclohexyl)benzenesulfonamide is sourced from PubChem (CID 2980145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).