N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide

C15H17NO2S — CID 836920

IUPACN-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccccc2C)c1
InChIInChI=1S/C15H17NO2S/c1-11-8-9-12(2)14(10-11)16-19(17,18)15-7-5-4-6-13(15)3/h4-10,16H,1-3H3
InChIKeyNUCFXYOLUINTLJ-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.41
Rot. Bonds3

About N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide

N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide (PubChem CID 836920) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide
PubChem CID836920
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC NameN-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccccc2C)c1
InChIInChI=1S/C15H17NO2S/c1-11-8-9-12(2)14(10-11)16-19(17,18)15-7-5-4-6-13(15)3/h4-10,16H,1-3H3
InChIKeyNUCFXYOLUINTLJ-UHFFFAOYSA-N
XLogP3.41
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide (CID 836920) is N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide is Cc1ccc(C)c(NS(=O)(=O)c2ccccc2C)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide?
The InChIKey is NUCFXYOLUINTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-11-8-9-12(2)14(10-11)16-19(17,18)15-7-5-4-6-13(15)3/h4-10,16H,1-3H3.
What are the key properties of N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide?
N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide has a molecular weight of 275.37 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide is sourced from PubChem (CID 836920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).