2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide

C15H23NO4S — CID 17377849

IUPAC2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)NC2CCC(C)CC2)c1
InChIInChI=1S/C15H23NO4S/c1-11-4-6-12(7-5-11)16-21(17,18)15-10-13(19-2)8-9-14(15)20-3/h8-12,16H,4-7H2,1-3H3
InChIKeyLCSBMWDAQVNWJF-UHFFFAOYSA-N
MW313.42 g/mol
LogP2.56
Rot. Bonds5

About 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide

2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide (PubChem CID 17377849) has the molecular formula C15H23NO4S and a molecular weight of 313.42 g/mol. Its IUPAC name is 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide
PubChem CID17377849
Molecular FormulaC15H23NO4S
Molecular Weight313.42 g/mol
Exact Mass313.13
IUPAC Name2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)NC2CCC(C)CC2)c1
InChIInChI=1S/C15H23NO4S/c1-11-4-6-12(7-5-11)16-21(17,18)15-10-13(19-2)8-9-14(15)20-3/h8-12,16H,4-7H2,1-3H3
InChIKeyLCSBMWDAQVNWJF-UHFFFAOYSA-N
XLogP2.56
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,5-dimethoxy-N-(4-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

Related Compounds

N-(1-cyclopropylpiperidin-4-yl)-2,5-dimethoxybenzenesulfonamide
CID 18141546
2,5-dimethoxy-N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79686260
2,5-dimethoxy-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586052
2,5-dimethoxy-N-[(1R,2R)-2-methylcyclohexyl]benzenesulfonamide
CID 768909
5-tert-butyl-N-cyclopropyl-2-methoxybenzenesulfonamide
CID 110757527
3-(cyclopentylsulfamoyl)-4-methoxy-N-(4-methylcyclohexyl)benzamide
CID 2579929
ethyl 4-[(2,5-dimethoxyphenyl)sulfonylamino]piperidine-1-carboxylate
CID 32944673
N-[4-(cyclopropylamino)phenyl]-2,5-dimethoxybenzenesulfonamide
CID 112980039
2,5-dimethoxy-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]benzenesulfonamide
CID 60540087
N-cyclopropyl-2-[2-(2,5-dimethoxyphenyl)sulfonylhydrazinyl]-2-oxoacetamide
CID 8841327
5-bromo-2-methoxy-N-(3-methylcyclobutyl)benzenesulfonamide
CID 113248092
5-amino-N-(4-ethylcyclohexyl)-2-methoxybenzenesulfonamide
CID 61467171

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide?
The IUPAC name of 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide (CID 17377849) is 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide.
What is the SMILES notation for 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide?
The canonical SMILES for 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide is COc1ccc(OC)c(S(=O)(=O)NC2CCC(C)CC2)c1.
What is the InChIKey of 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide?
The InChIKey is LCSBMWDAQVNWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4S/c1-11-4-6-12(7-5-11)16-21(17,18)15-10-13(19-2)8-9-14(15)20-3/h8-12,16H,4-7H2,1-3H3.
What are the key properties of 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide?
2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide has a molecular weight of 313.42 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-(4-methylcyclohexyl)benzenesulfonamide is sourced from PubChem (CID 17377849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).