2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide

C13H14N2O2S — CID 78955887

IUPAC2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccccc2C)ccn1
InChIInChI=1S/C13H14N2O2S/c1-10-5-3-4-6-13(10)18(16,17)15-12-7-8-14-11(2)9-12/h3-9H,1-2H3,(H,14,15)
InChIKeyYAKRKLNACVVMHP-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.50
Rot. Bonds3

About 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide

2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide (PubChem CID 78955887) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
PubChem CID78955887
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccccc2C)ccn1
InChIInChI=1S/C13H14N2O2S/c1-10-5-3-4-6-13(10)18(16,17)15-12-7-8-14-11(2)9-12/h3-9H,1-2H3,(H,14,15)
InChIKeyYAKRKLNACVVMHP-UHFFFAOYSA-N
XLogP2.50
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 79240316
2-hydrazinyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 79240880
N-(2-methyl-4-pyridinyl)-2-(propylamino)benzenesulfonamide
CID 79233091
4-ethoxy-2,5-dimethyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 110756905
2-methyl-N-phenylbenzenesulfonamide
CID 3017048
N-(2-methyl-4-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 79233082
4-methoxy-2,3,5-trimethyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 110758398
5-(aminomethyl)-2,4-dimethyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 106071279
2-methyl-N-[4-methyl-3-[(2-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 990525
N-(3-aminophenyl)-2-methylbenzenesulfonamide
CID 39362189
N-(3-amino-4-methylphenyl)-2-methylbenzenesulfonamide
CID 39375386
N-(2,3-dimethylquinoxalin-6-yl)-2-methylbenzenesulfonamide
CID 110723878

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The IUPAC name of 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide (CID 78955887) is 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide is Cc1cc(NS(=O)(=O)c2ccccc2C)ccn1.
What is the InChIKey of 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The InChIKey is YAKRKLNACVVMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-10-5-3-4-6-13(10)18(16,17)15-12-7-8-14-11(2)9-12/h3-9H,1-2H3,(H,14,15).
What are the key properties of 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide has a molecular weight of 262.33 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 78955887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).