2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile

C23H15N3O — CID 10132540

IUPAC2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile
SMILESN#Cc1ccccc1-c1cc(-c2ccccc2)cn(-c2ccccn2)c1=O
InChIInChI=1S/C23H15N3O/c24-15-18-10-4-5-11-20(18)21-14-19(17-8-2-1-3-9-17)16-26(23(21)27)22-12-6-7-13-25-22/h1-14,16H
InChIKeyBDAUQVDIEIVKDH-UHFFFAOYSA-N
MW349.39 g/mol
LogP4.44
Rot. Bonds3

About 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile

2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile (PubChem CID 10132540) has the molecular formula C23H15N3O and a molecular weight of 349.39 g/mol. Its IUPAC name is 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile.

Molecular Properties

Compound Name2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile
PubChem CID10132540
Molecular FormulaC23H15N3O
Molecular Weight349.39 g/mol
Exact Mass349.12
IUPAC Name2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile
SMILESN#Cc1ccccc1-c1cc(-c2ccccc2)cn(-c2ccccn2)c1=O
InChIInChI=1S/C23H15N3O/c24-15-18-10-4-5-11-20(18)21-14-19(17-8-2-1-3-9-17)16-26(23(21)27)22-12-6-7-13-25-22/h1-14,16H
InChIKeyBDAUQVDIEIVKDH-UHFFFAOYSA-N
XLogP4.44
TPSA58.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile?
The IUPAC name of 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile (CID 10132540) is 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile.
What is the SMILES notation for 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile?
The canonical SMILES for 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile is N#Cc1ccccc1-c1cc(-c2ccccc2)cn(-c2ccccn2)c1=O.
What is the InChIKey of 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile?
The InChIKey is BDAUQVDIEIVKDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O/c24-15-18-10-4-5-11-20(18)21-14-19(17-8-2-1-3-9-17)16-26(23(21)27)22-12-6-7-13-25-22/h1-14,16H.
What are the key properties of 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile?
2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile has a molecular weight of 349.39 g/mol, XLogP of 4.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-5-phenyl-1-pyridin-2-yl-3-pyridinyl)benzonitrile is sourced from PubChem (CID 10132540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).