2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide

C14H16N2O3S — CID 47389435

IUPAC2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccc(=O)n(C)c2)c1
InChIInChI=1S/C14H16N2O3S/c1-10-4-5-11(2)13(8-10)20(18,19)15-12-6-7-14(17)16(3)9-12/h4-9,15H,1-3H3
InChIKeyPPKBMIWWXXQDDP-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.80
Rot. Bonds3

About 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide

2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide (PubChem CID 47389435) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
PubChem CID47389435
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccc(=O)n(C)c2)c1
InChIInChI=1S/C14H16N2O3S/c1-10-4-5-11(2)13(8-10)20(18,19)15-12-6-7-14(17)16(3)9-12/h4-9,15H,1-3H3
InChIKeyPPKBMIWWXXQDDP-UHFFFAOYSA-N
XLogP1.80
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 47389423
2,5-dimethyl-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]benzenesulfonamide
CID 110730588
2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)thiophene-3-sulfonamide
CID 47072250
3-chloro-4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 47389543
2-amino-3,6-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 103171310
3-amino-5-chloro-2-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 114379246
2,5-dimethyl-N-(4-phenylphenyl)benzenesulfonamide
CID 925055
1,3-bis[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]urea
CID 170548873
N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 793232
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-2,5-dimethylbenzenesulfonamide
CID 22202628
2-amino-6-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 61125702
N-(1,3-diethyl-2-oxobenzimidazol-5-yl)-2,5-dimethylbenzenesulfonamide
CID 50796603

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide (CID 47389435) is 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide is Cc1ccc(C)c(S(=O)(=O)Nc2ccc(=O)n(C)c2)c1.
What is the InChIKey of 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide?
The InChIKey is PPKBMIWWXXQDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-10-4-5-11(2)13(8-10)20(18,19)15-12-6-7-14(17)16(3)9-12/h4-9,15H,1-3H3.
What are the key properties of 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide?
2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 47389435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).