2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one

C15H12N2O2 — CID 10848404

IUPAC2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one
SMILESCOc1ccc(-c2cc(=O)n3ccccc3n2)cc1
InChIInChI=1S/C15H12N2O2/c1-19-12-7-5-11(6-8-12)13-10-15(18)17-9-3-2-4-14(17)16-13/h2-10H,1H3
InChIKeyNLFCUULYXAZPBO-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.37
Rot. Bonds2

About 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one

2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 10848404) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one
PubChem CID10848404
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one
SMILESCOc1ccc(-c2cc(=O)n3ccccc3n2)cc1
InChIInChI=1S/C15H12N2O2/c1-19-12-7-5-11(6-8-12)13-10-15(18)17-9-3-2-4-14(17)16-13/h2-10H,1H3
InChIKeyNLFCUULYXAZPBO-UHFFFAOYSA-N
XLogP2.37
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one (CID 10848404) is 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one is COc1ccc(-c2cc(=O)n3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is NLFCUULYXAZPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-19-12-7-5-11(6-8-12)13-10-15(18)17-9-3-2-4-14(17)16-13/h2-10H,1H3.
What are the key properties of 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one?
2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 252.27 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 10848404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).