N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide

C15H17NO3S — CID 62997670

IUPACN-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccccc2C)c(C)c1
InChIInChI=1S/C15H17NO3S/c1-11-6-4-5-7-15(11)20(17,18)16-14-9-8-13(19-3)10-12(14)2/h4-10,16H,1-3H3
InChIKeyVXRGXGKHMUMJJD-UHFFFAOYSA-N
MW291.37 g/mol
LogP3.11
Rot. Bonds4

About N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide

N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide (PubChem CID 62997670) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide
PubChem CID62997670
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC NameN-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccccc2C)c(C)c1
InChIInChI=1S/C15H17NO3S/c1-11-6-4-5-7-15(11)20(17,18)16-14-9-8-13(19-3)10-12(14)2/h4-10,16H,1-3H3
InChIKeyVXRGXGKHMUMJJD-UHFFFAOYSA-N
XLogP3.11
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxy-2-methylphenyl)-2-(methylamino)benzenesulfonamide
CID 62871193
N-(4-methoxy-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 22202548
N-[4-(2,4-dimethoxyanilino)phenyl]-2-methylbenzenesulfonamide
CID 112987972
2-amino-4-methoxy-N-(2-methylphenyl)benzenesulfonamide
CID 28522742
4-chloro-N-(4-methoxy-2-methylphenyl)-2,5-dimethylbenzenesulfonamide
CID 22202576
N-(4-methoxy-2-methylphenyl)methanesulfonamide
CID 15851883
N-(4-methoxy-2-methylphenyl)-2,1,3-benzothiadiazole-4-sulfonamide
CID 22202569
N-[4-(diethylamino)-2-methylphenyl]-4-methoxy-2-methylbenzenesulfonamide
CID 113098997
2-bromo-4-fluoro-N-(4-methoxy-2-methylphenyl)benzenesulfonamide
CID 62871190
N-(2,4-dimethoxyphenyl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 113098643
2-amino-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 28590092
2-(aminomethyl)-N-(4-methoxy-2-methylphenyl)thiophene-3-sulfonamide
CID 106056025

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide (CID 62997670) is N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide is COc1ccc(NS(=O)(=O)c2ccccc2C)c(C)c1.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide?
The InChIKey is VXRGXGKHMUMJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c1-11-6-4-5-7-15(11)20(17,18)16-14-9-8-13(19-3)10-12(14)2/h4-10,16H,1-3H3.
What are the key properties of N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide?
N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide has a molecular weight of 291.37 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide is sourced from PubChem (CID 62997670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).