N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide

C16H13N3O3S — CID 58692572

IUPACN-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cc(-c2ccncc2)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C16H13N3O3S/c20-16-15(19-23(21,22)14-4-2-1-3-5-14)10-13(11-18-16)12-6-8-17-9-7-12/h1-11,19H,(H,18,20)
InChIKeyIYFYJKQMPGEKRZ-UHFFFAOYSA-N
MW327.37 g/mol
LogP2.24
Rot. Bonds4

About N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide

N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide (PubChem CID 58692572) has the molecular formula C16H13N3O3S and a molecular weight of 327.37 g/mol. Its IUPAC name is N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide
PubChem CID58692572
Molecular FormulaC16H13N3O3S
Molecular Weight327.37 g/mol
Exact Mass327.07
IUPAC NameN-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cc(-c2ccncc2)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C16H13N3O3S/c20-16-15(19-23(21,22)14-4-2-1-3-5-14)10-13(11-18-16)12-6-8-17-9-7-12/h1-11,19H,(H,18,20)
InChIKeyIYFYJKQMPGEKRZ-UHFFFAOYSA-N
XLogP2.24
TPSA91.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Amrinone
CID 3698
4-Methyl-N-pyridin-2-ylmethyl-benzenesulfonamide
CID 731623
N'-isonicotinoylbenzenesulfonohydrazide
CID 468603
N-[4-(pyridin-2-ylmethylsulfamoyl)phenyl]acetamide
CID 720105
N-(4-{[(pyridin-4-yl)methyl]sulfamoyl}phenyl)acetamide
CID 720106
Sulfonamide deriv., 7h
CID 44520904
Sulfonamide deriv., 7i
CID 44520905
Piperazine moiety, 6
CID 57339813
(E)-N-[6-[3-[(2-methylphenyl)sulfamoyl]phenyl]hexyl]-3-pyridin-3-ylprop-2-enamide
CID 155537916
(E)-N-[6-[3-(phenylsulfamoyl)phenyl]hexyl]-3-pyridin-3-ylprop-2-enamide
CID 155549611
(E)-N-[6-[3-[(2,5-dimethylphenyl)sulfamoyl]phenyl]hexyl]-3-pyridin-3-ylprop-2-enamide
CID 155564947
(E)-N-[6-[3-[(4-fluorophenyl)sulfamoyl]phenyl]hexyl]-3-pyridin-3-ylprop-2-enamide
CID 155565565

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide?
The IUPAC name of N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide (CID 58692572) is N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide?
The canonical SMILES for N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide is O=c1[nH]cc(-c2ccncc2)cc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide?
The InChIKey is IYFYJKQMPGEKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O3S/c20-16-15(19-23(21,22)14-4-2-1-3-5-14)10-13(11-18-16)12-6-8-17-9-7-12/h1-11,19H,(H,18,20).
What are the key properties of N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide?
N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide has a molecular weight of 327.37 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzenesulfonamide is sourced from PubChem (CID 58692572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).