N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide

C19H16N2O3S — CID 10066599

IUPACN-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide
SMILESCN(c1ccc(C(=O)c2cccnc2)cc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H16N2O3S/c1-21(25(23,24)18-7-3-2-4-8-18)17-11-9-15(10-12-17)19(22)16-6-5-13-20-14-16/h2-14H,1H3
InChIKeyWOGLJQFDNYKFMX-UHFFFAOYSA-N
MW352.42 g/mol
LogP3.14
Rot. Bonds5

About N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide

N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide (PubChem CID 10066599) has the molecular formula C19H16N2O3S and a molecular weight of 352.42 g/mol. Its IUPAC name is N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide
PubChem CID10066599
Molecular FormulaC19H16N2O3S
Molecular Weight352.42 g/mol
Exact Mass352.09
IUPAC NameN-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide
SMILESCN(c1ccc(C(=O)c2cccnc2)cc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H16N2O3S/c1-21(25(23,24)18-7-3-2-4-8-18)17-11-9-15(10-12-17)19(22)16-6-5-13-20-14-16/h2-14H,1H3
InChIKeyWOGLJQFDNYKFMX-UHFFFAOYSA-N
XLogP3.14
TPSA67.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[benzenesulfonyl(methyl)amino]benzoic acid
CID 804306
N'-hydroxy-4-[methyl(pyridin-3-ylsulfonyl)amino]benzenecarboximidamide
CID 76979395
4-[methyl(phenyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 4801676
pyridin-3-ylmethyl 4-[methyl(phenyl)sulfamoyl]benzoate
CID 18083751
4-[methyl-(4-methylphenyl)sulfonylamino]-N-pyridin-3-ylbenzamide
CID 1210805
N-[4-[4-[4-[benzenesulfonyl(methyl)amino]benzoyl]piperazine-1-carbonyl]phenyl]-N-methylbenzenesulfonamide
CID 3119066
[4-[benzenesulfonyl(methyl)amino]phenyl] pyrazine-2-carboxylate
CID 18075166
4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-pyridin-3-ylbenzamide
CID 1242126
N,N-diphenylbenzenesulfonamide;N-methyl-N-phenylbenzenesulfonamide
CID 158565705
N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 21236527
[3-(dimethylamino)phenyl]-pyridin-3-ylmethanone
CID 105081243
N-(4-bromophenyl)-N-methylbenzenesulfonamide
CID 5171346

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide?
The IUPAC name of N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide (CID 10066599) is N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide.
What is the SMILES notation for N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide?
The canonical SMILES for N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide is CN(c1ccc(C(=O)c2cccnc2)cc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide?
The InChIKey is WOGLJQFDNYKFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3S/c1-21(25(23,24)18-7-3-2-4-8-18)17-11-9-15(10-12-17)19(22)16-6-5-13-20-14-16/h2-14H,1H3.
What are the key properties of N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide?
N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide has a molecular weight of 352.42 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide is sourced from PubChem (CID 10066599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).