3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one

C16H12N2O2 — CID 67419505

IUPAC3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one
SMILESO=c1ccn(-c2cc(-c3ccccc3)ccn2)cc1O
InChIInChI=1S/C16H12N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-11,20H
InChIKeyQWTHMOHMTPERDO-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.61
Rot. Bonds2

About 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one

3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one (PubChem CID 67419505) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one.

Molecular Properties

Compound Name3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one
PubChem CID67419505
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one
SMILESO=c1ccn(-c2cc(-c3ccccc3)ccn2)cc1O
InChIInChI=1S/C16H12N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-11,20H
InChIKeyQWTHMOHMTPERDO-UHFFFAOYSA-N
XLogP2.61
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one?
The IUPAC name of 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one (CID 67419505) is 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one.
What is the SMILES notation for 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one?
The canonical SMILES for 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one is O=c1ccn(-c2cc(-c3ccccc3)ccn2)cc1O.
What is the InChIKey of 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one?
The InChIKey is QWTHMOHMTPERDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-11,20H.
What are the key properties of 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one?
3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one has a molecular weight of 264.28 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one is sourced from PubChem (CID 67419505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).