4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide

C15H24N2O2S — CID 79588504

IUPAC4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
SMILESCc1cc(N)cc(C)c1S(=O)(=O)NC1CCCCC1C
InChIInChI=1S/C15H24N2O2S/c1-10-6-4-5-7-14(10)17-20(18,19)15-11(2)8-13(16)9-12(15)3/h8-10,14,17H,4-7,16H2,1-3H3
InChIKeyGWUNCKOMVSTJHX-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.74
Rot. Bonds3

About 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide

4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide (PubChem CID 79588504) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide.

Molecular Properties

Compound Name4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
PubChem CID79588504
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
SMILESCc1cc(N)cc(C)c1S(=O)(=O)NC1CCCCC1C
InChIInChI=1S/C15H24N2O2S/c1-10-6-4-5-7-14(10)17-20(18,19)15-11(2)8-13(16)9-12(15)3/h8-10,14,17H,4-7,16H2,1-3H3
InChIKeyGWUNCKOMVSTJHX-UHFFFAOYSA-N
XLogP2.74
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-2,6-dichloro-N-(2-methylcyclohexyl)benzenesulfonamide
CID 43257649
4-amino-2-methyl-N-(2-methylcyclopentyl)benzenesulfonamide
CID 55172811
3,4-dimethyl-N-[(1R,2R)-2-methylcyclohexyl]benzenesulfonamide
CID 1256393
4-amino-2-bromo-N-(2-methylcyclohexyl)benzenesulfonamide
CID 43256037
5-amino-3-chloro-2-fluoro-N-(2-methylcyclohexyl)benzenesulfonamide
CID 43257648
3-amino-4-fluoro-5-methyl-N-(2-methylcycloheptyl)benzenesulfonamide
CID 115421698
N-[(1S,2S)-2-hydroxycyclohexyl]-2,4,6-trimethylbenzenesulfonamide
CID 104953218
4-amino-N-(3-hydroxycyclobutyl)-2,6-dimethylbenzenesulfonamide
CID 79588779
4,5-dichloro-2-methyl-N-[(1S,2S)-2-methylcyclohexyl]benzenesulfonamide
CID 39116281
2-methoxy-4,5-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 2984852
2,5-dibromo-4-methyl-N-(2-methylcycloheptyl)benzenesulfonamide
CID 81435568
4-methyl-N-[(1S,2S)-2-methylcyclohexyl]benzenesulfonamide
CID 11097522

Frequently Asked Questions

What is the IUPAC name of 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide?
The IUPAC name of 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide (CID 79588504) is 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide.
What is the SMILES notation for 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide?
The canonical SMILES for 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide is Cc1cc(N)cc(C)c1S(=O)(=O)NC1CCCCC1C.
What is the InChIKey of 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide?
The InChIKey is GWUNCKOMVSTJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-10-6-4-5-7-14(10)17-20(18,19)15-11(2)8-13(16)9-12(15)3/h8-10,14,17H,4-7,16H2,1-3H3.
What are the key properties of 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide?
4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,6-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide is sourced from PubChem (CID 79588504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).