2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one

C14H10N2O2 — CID 135399285

IUPAC2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESO=c1c(-c2ccccc2)c(O)nc2ccccn12
InChIInChI=1S/C14H10N2O2/c17-13-12(10-6-2-1-3-7-10)14(18)16-9-5-4-8-11(16)15-13/h1-9,17H
InChIKeyFILDARUBDGCDIX-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.07
Rot. Bonds1

About 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one

2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 135399285) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one
PubChem CID135399285
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESO=c1c(-c2ccccc2)c(O)nc2ccccn12
InChIInChI=1S/C14H10N2O2/c17-13-12(10-6-2-1-3-7-10)14(18)16-9-5-4-8-11(16)15-13/h1-9,17H
InChIKeyFILDARUBDGCDIX-UHFFFAOYSA-N
XLogP2.07
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Mls002693570
CID 248888
2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one
CID 776568
3-benzyl-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 13243149
4H-Pyrido[1,2-a]pyrimidin-4-one, 2,3-diphenyl-
CID 12235379
3-benzyl-2-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one
CID 135454301
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-hydroxy-3-phenyl-
CID 135574819
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(2-dimethylaminoethoxy)-3-phenyl-, hydrobromide
CID 88847
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(3-(dimethylamino)-2-methylpropoxy)-3-phenyl-, hydrobromide
CID 89475
3-Naphthalen-1-ylpyrido[1,2-a]pyrimidin-4-one
CID 122203480
3-(4-Methylphenyl)pyrido[1,2-a]pyrimidin-4-one
CID 122203481
2-hydroxy-8-methyl-4-oxo-N-(2-phenylethyl)-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
CID 135458483
4H-Pyrazino(1,2-a)pyrimidin-4-one, 2-(cyanomethoxy)-3-phenyl-
CID 87666

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one (CID 135399285) is 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one is O=c1c(-c2ccccc2)c(O)nc2ccccn12.
What is the InChIKey of 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is FILDARUBDGCDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-13-12(10-6-2-1-3-7-10)14(18)16-9-5-4-8-11(16)15-13/h1-9,17H.
What are the key properties of 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one?
2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 238.25 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-phenylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 135399285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).