2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide

C15H24N2O2S — CID 64753384

IUPAC2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1NC1CC(C)CC(C)C1
InChIInChI=1S/C15H24N2O2S/c1-11-8-12(2)10-13(9-11)17-14-6-4-5-7-15(14)20(18,19)16-3/h4-7,11-13,16-17H,8-10H2,1-3H3
InChIKeyHPKAQXFXUDYPFH-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.83
Rot. Bonds4

About 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide

2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide (PubChem CID 64753384) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide
PubChem CID64753384
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1NC1CC(C)CC(C)C1
InChIInChI=1S/C15H24N2O2S/c1-11-8-12(2)10-13(9-11)17-14-6-4-5-7-15(14)20(18,19)16-3/h4-7,11-13,16-17H,8-10H2,1-3H3
InChIKeyHPKAQXFXUDYPFH-UHFFFAOYSA-N
XLogP2.83
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-methylbenzenesulfonamide
CID 43454291
N-methyl-2-[(3,3,5-trimethylcyclohexyl)amino]benzenesulfonamide
CID 43749905
2-[(4-ethylcyclohexyl)amino]-N-methylbenzenesulfonamide
CID 43749872
2-methyl-3-[(3-methylcyclobutyl)amino]benzenesulfonamide
CID 103561715
N-cyclopropyl-2-[(4-methylcyclohexyl)amino]benzenesulfonamide
CID 43454668
2-[(3,3-dimethylcyclopentyl)amino]-N-methylbenzenesulfonamide
CID 80705108
N-methyl-2-[(6-oxopiperidin-3-yl)amino]benzenesulfonamide
CID 63661248
2-[(3-methylcyclohexyl)amino]-N-propylbenzenesulfonamide
CID 43454559
N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide
CID 43454646
N-methyl-2-[(2-methylpiperidin-3-yl)amino]benzenesulfonamide
CID 114695588
2-chloro-N-(3-methylcyclobutyl)aniline
CID 104860161
2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylbenzenesulfonamide
CID 64921417

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide?
The IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide (CID 64753384) is 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide.
What is the SMILES notation for 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide?
The canonical SMILES for 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide is CNS(=O)(=O)c1ccccc1NC1CC(C)CC(C)C1.
What is the InChIKey of 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide?
The InChIKey is HPKAQXFXUDYPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-11-8-12(2)10-13(9-11)17-14-6-4-5-7-15(14)20(18,19)16-3/h4-7,11-13,16-17H,8-10H2,1-3H3.
What are the key properties of 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide?
2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide is sourced from PubChem (CID 64753384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).