1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one

C15H13N3O2 — CID 15652997

IUPAC1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one
SMILESCOc1ccc(-n2c(C)nc(=O)c3cccnc32)cc1
InChIInChI=1S/C15H13N3O2/c1-10-17-15(19)13-4-3-9-16-14(13)18(10)11-5-7-12(20-2)8-6-11/h3-9H,1-2H3
InChIKeyVUCGOHZEZUFWFL-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.10
Rot. Bonds2

About 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one

1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one (PubChem CID 15652997) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one
PubChem CID15652997
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one
SMILESCOc1ccc(-n2c(C)nc(=O)c3cccnc32)cc1
InChIInChI=1S/C15H13N3O2/c1-10-17-15(19)13-4-3-9-16-14(13)18(10)11-5-7-12(20-2)8-6-11/h3-9H,1-2H3
InChIKeyVUCGOHZEZUFWFL-UHFFFAOYSA-N
XLogP2.10
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methoxyphenyl)-3-methylpyrrolo[2,3-b]pyridine
CID 102389456
4-(4-methoxyphenyl)-1H-pyrido[2,3-b]pyrazine-2,3-dione
CID 20565458
N-(2-fluoro-4-methylphenyl)-4-hydroxy-1-(4-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 54726909
3-(4-fluorophenyl)-2-methylimidazo[4,5-b]pyridine
CID 14119097
2,7-dimethyl-1-(4-methylphenyl)pyrido[2,3-d]pyrimidin-4-one
CID 13397837
3-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-2-thione
CID 79290028
10-[(4-methoxyphenyl)methyl]pyrido[2,3-b][1,8]naphthyridin-5-one
CID 132515576
3-(4-methoxyphenyl)-2-propan-2-ylimidazo[4,5-b]pyridine
CID 117166531
3-(4-methoxyphenyl)-2-methylbenzo[g]quinazolin-4-one
CID 44725647
N-(2-chlorophenyl)-4-hydroxy-1-(4-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 54726905
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 55661317
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-hydroxy-1-(4-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 98235517

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one (CID 15652997) is 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one is COc1ccc(-n2c(C)nc(=O)c3cccnc32)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one?
The InChIKey is VUCGOHZEZUFWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-10-17-15(19)13-4-3-9-16-14(13)18(10)11-5-7-12(20-2)8-6-11/h3-9H,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one?
1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one has a molecular weight of 267.29 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-methylpyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 15652997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).