4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide

C20H25NO4S — CID 7940687

IUPAC4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C3CCCCC3)cc2)c(OC)c1
InChIInChI=1S/C20H25NO4S/c1-24-17-10-13-19(20(14-17)25-2)21-26(22,23)18-11-8-16(9-12-18)15-6-4-3-5-7-15/h8-15,21H,3-7H2,1-2H3
InChIKeyCJDNDVZGXLPSBI-UHFFFAOYSA-N
MW375.49 g/mol
LogP4.55
Rot. Bonds6

About 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide

4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide (PubChem CID 7940687) has the molecular formula C20H25NO4S and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
PubChem CID7940687
Molecular FormulaC20H25NO4S
Molecular Weight375.49 g/mol
Exact Mass375.15
IUPAC Name4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C3CCCCC3)cc2)c(OC)c1
InChIInChI=1S/C20H25NO4S/c1-24-17-10-13-19(20(14-17)25-2)21-26(22,23)18-11-8-16(9-12-18)15-6-4-3-5-7-15/h8-15,21H,3-7H2,1-2H3
InChIKeyCJDNDVZGXLPSBI-UHFFFAOYSA-N
XLogP4.55
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
CID 46764272
4-cyclohexyl-N-(2,3,4-trifluorophenyl)benzenesulfonamide
CID 7939033
methyl 4-[[4-(4-cyclohexylphenyl)-3-fluorophenyl]sulfonylamino]-3-methoxybenzoate
CID 167476700
N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 7586552
N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CID 167861168
N-(2,4-dimethoxyphenyl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 113098643
N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]-2-methylbutanamide
CID 21335908
4-methoxy-N-(5-methoxy-2-methylphenyl)benzenesulfonamide
CID 4564561
N-(4-methoxy-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 22202548
4-chloro-N-(2-chloro-4-methoxyphenyl)benzenesulfonamide
CID 4994976
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide
CID 8615574

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide?
The IUPAC name of 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide (CID 7940687) is 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide is COc1ccc(NS(=O)(=O)c2ccc(C3CCCCC3)cc2)c(OC)c1.
What is the InChIKey of 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide?
The InChIKey is CJDNDVZGXLPSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO4S/c1-24-17-10-13-19(20(14-17)25-2)21-26(22,23)18-11-8-16(9-12-18)15-6-4-3-5-7-15/h8-15,21H,3-7H2,1-2H3.
What are the key properties of 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide?
4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide has a molecular weight of 375.49 g/mol, XLogP of 4.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 7940687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).