N-(2-amino-1-cyclohexylethyl)benzenesulfonamide

C14H22N2O2S — CID 61122381

IUPACN-(2-amino-1-cyclohexylethyl)benzenesulfonamide
SMILESNCC(NS(=O)(=O)c1ccccc1)C1CCCCC1
InChIInChI=1S/C14H22N2O2S/c15-11-14(12-7-3-1-4-8-12)16-19(17,18)13-9-5-2-6-10-13/h2,5-6,9-10,12,14,16H,1,3-4,7-8,11,15H2
InChIKeyVMPGPRVGGJZPDJ-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.87
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)benzenesulfonamide

N-(2-amino-1-cyclohexylethyl)benzenesulfonamide (PubChem CID 61122381) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)benzenesulfonamide
PubChem CID61122381
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-(2-amino-1-cyclohexylethyl)benzenesulfonamide
SMILESNCC(NS(=O)(=O)c1ccccc1)C1CCCCC1
InChIInChI=1S/C14H22N2O2S/c15-11-14(12-7-3-1-4-8-12)16-19(17,18)13-9-5-2-6-10-13/h2,5-6,9-10,12,14,16H,1,3-4,7-8,11,15H2
InChIKeyVMPGPRVGGJZPDJ-UHFFFAOYSA-N
XLogP1.87
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopentylethyl)-4-chlorobenzenesulfonamide
CID 106737819
N-(2-amino-1-cyclohexylethyl)-2-phenylpyrimidine-5-sulfonamide;hydrochloride
CID 120710800
N-(2-amino-1-cyclohexylethyl)-3-cyanobenzenesulfonamide
CID 115309375
N-[2-(benzenesulfonamido)-1,2-dicyclohexylethyl]benzenesulfonamide
CID 67266397
4-[(2-amino-1-cyclopentylethyl)sulfamoyl]benzamide
CID 106737961
N-[(1R)-1-cycloheptylethyl]benzenesulfonamide
CID 81393099
N-(2-amino-1-cyclohexylethyl)-3,5-difluorobenzenesulfonamide
CID 115309326
N-(2-amino-1-cyclopentylethyl)-4-nitrobenzenesulfonamide;hydrochloride
CID 86820092
N-(2-amino-1-cyclopentylethyl)-4-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120585169
4-N-(2-amino-1-cyclopropylethyl)-1-N-cyclopropylbenzene-1,4-disulfonamide
CID 119986909
N-(2-amino-1-cyclohexylethyl)-4-(2,2-difluoroethoxy)benzenesulfonamide
CID 120710791
N-[(1S)-1-cyclopentylethyl]benzenesulfonamide
CID 81388674

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)benzenesulfonamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)benzenesulfonamide (CID 61122381) is N-(2-amino-1-cyclohexylethyl)benzenesulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)benzenesulfonamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)benzenesulfonamide is NCC(NS(=O)(=O)c1ccccc1)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)benzenesulfonamide?
The InChIKey is VMPGPRVGGJZPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c15-11-14(12-7-3-1-4-8-12)16-19(17,18)13-9-5-2-6-10-13/h2,5-6,9-10,12,14,16H,1,3-4,7-8,11,15H2.
What are the key properties of N-(2-amino-1-cyclohexylethyl)benzenesulfonamide?
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide has a molecular weight of 282.41 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)benzenesulfonamide is sourced from PubChem (CID 61122381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).