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

C17H16N2O — CID 56647938

IUPAC8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESCCc1ccn2c(=O)c(C)c(-c3ccccc3)nc2c1
InChIInChI=1S/C17H16N2O/c1-3-13-9-10-19-15(11-13)18-16(12(2)17(19)20)14-7-5-4-6-8-14/h4-11H,3H2,1-2H3
InChIKeyZMIZBQJMSYUCSK-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.23
Rot. Bonds2

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

8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 56647938) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one
PubChem CID56647938
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one
SMILESCCc1ccn2c(=O)c(C)c(-c3ccccc3)nc2c1
InChIInChI=1S/C17H16N2O/c1-3-13-9-10-19-15(11-13)18-16(12(2)17(19)20)14-7-5-4-6-8-14/h4-11H,3H2,1-2H3
InChIKeyZMIZBQJMSYUCSK-UHFFFAOYSA-N
XLogP3.23
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Phenyl-2H-pyrido(1,2-A)pyrimidin-2-one
CID 3813423
Seganserin
CID 71767
8-(phenylethynyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 53317110
1-benzyl-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
CID 704582
7-methyl-4-oxo-N-(1-phenylethyl)-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
CID 16010494
2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one
CID 776568
8-methyl-2-phenyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 377423
2-(4-Chlorophenyl)pyrido[1,2-a]pyrimidin-4-one
CID 10563061
7,9-Dichloro-2-phenylpyrido[1,2-a]pyrimidin-4-one
CID 288319
1-benzyl-2,6-dimethyl-5-phenyl-4(1H)-pyrimidinone
CID 781510
2-(Benzylamino)pyrido[1,2-a]pyrimidin-4-one
CID 2314144
7-benzyl-N-butyl-6-imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
CID 4389996

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one (CID 56647938) is 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one is CCc1ccn2c(=O)c(C)c(-c3ccccc3)nc2c1.
What is the InChIKey of 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is ZMIZBQJMSYUCSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-3-13-9-10-19-15(11-13)18-16(12(2)17(19)20)14-7-5-4-6-8-14/h4-11H,3H2,1-2H3.
What are the key properties of 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one?
8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 264.33 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-3-methyl-2-phenylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 56647938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).