4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide

C15H24N2O2S — CID 43110382

IUPAC4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide
SMILESCC(N)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
InChIInChI=1S/C15H24N2O2S/c1-12(16)13-8-10-15(11-9-13)20(18,19)17(2)14-6-4-3-5-7-14/h8-12,14H,3-7,16H2,1-2H3
InChIKeyZTMLELPUPBQRQI-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.66
Rot. Bonds4

About 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide

4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide (PubChem CID 43110382) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide
PubChem CID43110382
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide
SMILESCC(N)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
InChIInChI=1S/C15H24N2O2S/c1-12(16)13-8-10-15(11-9-13)20(18,19)17(2)14-6-4-3-5-7-14/h8-12,14H,3-7,16H2,1-2H3
InChIKeyZTMLELPUPBQRQI-UHFFFAOYSA-N
XLogP2.66
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide 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

Mafenide
CID 3998
Mafenide Hydrochloride
CID 67313
N-Cyclohexyl-4-methylbenzenesulfonamide
CID 6633
Glycyclamide
CID 12628
4-(2-Aminoethyl)benzenesulfonamide
CID 169682
N-Butyl-p-toluenesulfonamide
CID 61285
p-Toluenesulfonamide, N-benzyl-
CID 95801
Benzenesulfonamide, N-benzyl-
CID 95236
4-(2-((Cyclohexylcarbamoyl)amino)ethyl)benzenesulfonamide
CID 841429
(2-Cyclohex-1-enylethyl)[(4-methylphenyl)sulfonyl]amine
CID 737669
Benzenesulfonamide, N-(3-(dimethylamino)propyl)-4-methyl-
CID 202375
4-[1-(Methylamino)ethyl]benzene-1-sulfonamide
CID 4961836

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide?
The IUPAC name of 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide (CID 43110382) is 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide.
What is the SMILES notation for 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide?
The canonical SMILES for 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide is CC(N)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1.
What is the InChIKey of 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide?
The InChIKey is ZTMLELPUPBQRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-12(16)13-8-10-15(11-9-13)20(18,19)17(2)14-6-4-3-5-7-14/h8-12,14H,3-7,16H2,1-2H3.
What are the key properties of 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide?
4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethyl)-N-cyclohexyl-N-methylbenzenesulfonamide is sourced from PubChem (CID 43110382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).