2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide

C13H15N3O2S — CID 55044083

IUPAC2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)Nc2cccc(C)c2)ccn1
InChIInChI=1S/C13H15N3O2S/c1-10-4-3-5-11(8-10)16-19(17,18)12-6-7-15-13(9-12)14-2/h3-9,16H,1-2H3,(H,14,15)
InChIKeyONESMNGDCWVFCZ-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.23
Rot. Bonds4

About 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide

2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide (PubChem CID 55044083) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
PubChem CID55044083
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC Name2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)Nc2cccc(C)c2)ccn1
InChIInChI=1S/C13H15N3O2S/c1-10-4-3-5-11(8-10)16-19(17,18)12-6-7-15-13(9-12)14-2/h3-9,16H,1-2H3,(H,14,15)
InChIKeyONESMNGDCWVFCZ-UHFFFAOYSA-N
XLogP2.23
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62144171
2-(methylamino)-N-(3-methylsulfanylphenyl)pyridine-4-sulfonamide
CID 62164043
2-chloro-N-(3-methylphenyl)pyridine-4-sulfonamide
CID 54895572
2-(methylamino)-N-(3-nitrophenyl)pyridine-4-sulfonamide
CID 62143197
N-(4-fluoro-3-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62811577
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62143380
N-(1,3-benzothiazol-6-yl)-2-(methylamino)pyridine-4-sulfonamide
CID 107801209
N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62148302
N-(3-methylphenyl)-3-[3-[(3-methylphenyl)sulfamoyl]phenyl]sulfonylbenzenesulfonamide
CID 3091379
4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
N-(5-bromo-3-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-sulfonamide
CID 83170253
N-(3-methylphenyl)naphthalene-2-sulfonamide
CID 965256

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide (CID 55044083) is 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)Nc2cccc(C)c2)ccn1.
What is the InChIKey of 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The InChIKey is ONESMNGDCWVFCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-10-4-3-5-11(8-10)16-19(17,18)12-6-7-15-13(9-12)14-2/h3-9,16H,1-2H3,(H,14,15).
What are the key properties of 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide has a molecular weight of 277.35 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 55044083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).