2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one

C15H11ClN2O — CID 10540006

IUPAC2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccc2nc(-c3cccc(Cl)c3)cc(=O)n12
InChIInChI=1S/C15H11ClN2O/c1-10-4-2-7-14-17-13(9-15(19)18(10)14)11-5-3-6-12(16)8-11/h2-9H,1H3
InChIKeyYQEFJXMTIUHWRH-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.32
Rot. Bonds1

About 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one

2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 10540006) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one
PubChem CID10540006
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccc2nc(-c3cccc(Cl)c3)cc(=O)n12
InChIInChI=1S/C15H11ClN2O/c1-10-4-2-7-14-17-13(9-15(19)18(10)14)11-5-3-6-12(16)8-11/h2-9H,1H3
InChIKeyYQEFJXMTIUHWRH-UHFFFAOYSA-N
XLogP3.32
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117142184
6-methyl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
CID 115023262
N-(4-oxo-2-phenylpyrido[1,2-a]pyrimidin-6-yl)acetamide
CID 14686968
6-(3-chlorophenyl)-2-methylpyridazin-3-one
CID 102592574
1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine
CID 84744696
3-(3-chlorophenyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-5-one
CID 117142187
2,5-bis(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 16641334
[(1S)-1-(4-chlorophenyl)ethyl]-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]azanium
CID 8710605
[(1R)-1-(4-chlorophenyl)ethyl]-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]azanium
CID 8710607
6-[4-(3-chlorophenyl)-2-methylimidazol-1-yl]-1-methylpyridin-2-one
CID 70804764
3-(3-chlorophenyl)-1-(3,5-dimethylphenyl)pyrazol-5-amine
CID 43542636
5-bromo-2-(3-chlorophenyl)imidazo[1,2-a]pyridine
CID 117133012

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one (CID 10540006) is 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one is Cc1cccc2nc(-c3cccc(Cl)c3)cc(=O)n12.
What is the InChIKey of 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is YQEFJXMTIUHWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c1-10-4-2-7-14-17-13(9-15(19)18(10)14)11-5-3-6-12(16)8-11/h2-9H,1H3.
What are the key properties of 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one?
2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 270.72 g/mol, XLogP of 3.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-6-methylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 10540006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).