N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide

C15H23NO2S — CID 3776153

IUPACN-(cyclohexylmethyl)-4-ethylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2CCCCC2)cc1
InChIInChI=1S/C15H23NO2S/c1-2-13-8-10-15(11-9-13)19(17,18)16-12-14-6-4-3-5-7-14/h8-11,14,16H,2-7,12H2,1H3
InChIKeyGMSSTJKOGDHVIK-UHFFFAOYSA-N
MW281.42 g/mol
LogP3.11
Rot. Bonds5

About N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide

N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide (PubChem CID 3776153) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-4-ethylbenzenesulfonamide
PubChem CID3776153
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC NameN-(cyclohexylmethyl)-4-ethylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2CCCCC2)cc1
InChIInChI=1S/C15H23NO2S/c1-2-13-8-10-15(11-9-13)19(17,18)16-12-14-6-4-3-5-7-14/h8-11,14,16H,2-7,12H2,1H3
InChIKeyGMSSTJKOGDHVIK-UHFFFAOYSA-N
XLogP3.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cycloheptylmethyl)-4-methylbenzenesulfonamide
CID 134942537
4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]benzenesulfonamide
CID 16887425
4-ethyl-N-[(3-hydroxycyclobutyl)methyl]benzenesulfonamide
CID 66006962
N-(cyclohexylmethyl)-4-(2-methylbutan-2-yl)benzenesulfonamide
CID 6733441
3-amino-N-(cyclopentylmethyl)-4-ethylbenzenesulfonamide
CID 43370862
4-(cyclohexylmethylsulfamoyl)benzoic acid
CID 18524305
4-(1-aminoethyl)-N-(cyclobutylmethyl)benzenesulfonamide
CID 43298854
2-N,7-N-bis(cyclohexylmethyl)-9-oxofluorene-2,7-disulfonamide
CID 136590042
4-N-cyclohexyl-1-N-(cyclopropylmethyl)-4-N-methylbenzene-1,4-disulfonamide
CID 1448139
N-(cycloheptylmethyl)-3,4-dimethoxybenzenesulfonamide
CID 3739924
2-[4-(cyclobutylmethylsulfamoyl)phenyl]ethanethioamide
CID 79184823
4-ethyl-N-[(1-phenylpyrrolidin-3-yl)methyl]benzenesulfonamide
CID 110640330

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide?
The IUPAC name of N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide (CID 3776153) is N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide.
What is the SMILES notation for N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide?
The canonical SMILES for N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide is CCc1ccc(S(=O)(=O)NCC2CCCCC2)cc1.
What is the InChIKey of N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide?
The InChIKey is GMSSTJKOGDHVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-2-13-8-10-15(11-9-13)19(17,18)16-12-14-6-4-3-5-7-14/h8-11,14,16H,2-7,12H2,1H3.
What are the key properties of N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide?
N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide has a molecular weight of 281.42 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide is sourced from PubChem (CID 3776153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).