2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one

C15H12N2O2 — CID 135445449

IUPAC2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1ccn2c(=O)c(-c3ccccc3)c(O)nc2c1
InChIInChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-14(18)13(15(17)19)11-5-3-2-4-6-11/h2-9,18H,1H3
InChIKeyHYPYDPKTCNIMTH-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.38
Rot. Bonds1

About 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one

2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 135445449) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one
PubChem CID135445449
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1ccn2c(=O)c(-c3ccccc3)c(O)nc2c1
InChIInChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-14(18)13(15(17)19)11-5-3-2-4-6-11/h2-9,18H,1H3
InChIKeyHYPYDPKTCNIMTH-UHFFFAOYSA-N
XLogP2.38
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one (CID 135445449) is 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one is Cc1ccn2c(=O)c(-c3ccccc3)c(O)nc2c1.
What is the InChIKey of 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is HYPYDPKTCNIMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-14(18)13(15(17)19)11-5-3-2-4-6-11/h2-9,18H,1H3.
What are the key properties of 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one?
2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 252.27 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-8-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 135445449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).