3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one

C15H13N3O2 — CID 10825717

IUPAC3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one
SMILESCOc1ccccc1Cn1cnc2ncccc2c1=O
InChIInChI=1S/C15H13N3O2/c1-20-13-7-3-2-5-11(13)9-18-10-17-14-12(15(18)19)6-4-8-16-14/h2-8,10H,9H2,1H3
InChIKeyIXCXMBCZCFEYJB-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.85
Rot. Bonds3

About 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one

3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one (PubChem CID 10825717) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one
PubChem CID10825717
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one
SMILESCOc1ccccc1Cn1cnc2ncccc2c1=O
InChIInChI=1S/C15H13N3O2/c1-20-13-7-3-2-5-11(13)9-18-10-17-14-12(15(18)19)6-4-8-16-14/h2-8,10H,9H2,1H3
InChIKeyIXCXMBCZCFEYJB-UHFFFAOYSA-N
XLogP1.85
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2,6-dimethoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one
CID 39754045
5-deuterio-3-[(2-methoxyphenyl)methyl]quinazolin-4-one
CID 175898338
3-(1H-indol-4-ylmethyl)pyrido[2,3-d]pyrimidin-4-one
CID 39794219
3-[(2-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one
CID 33278584
3-[3-(2-bromophenyl)propyl]pyrido[2,3-d]pyrimidin-4-one
CID 119051463
3-[(2-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyrimidin-4-one
CID 136535535
3-[(5-chloro-2-pyridinyl)methyl]pyrido[2,3-d]pyrimidin-4-one
CID 154754059
3-[(2,6-difluoro-4-phenylphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one
CID 121275669
6,7,8-trimethoxy-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]quinazolin-4-one
CID 171915041
ethane;1-[(2-methoxyphenyl)methyl]-2-methylimidazole
CID 144668203
3-[(2-methylphenyl)methyl]pteridin-4-one
CID 39826329
3-[3-[(2-methoxyphenyl)methyl]imidazol-4-yl]pyridin-2-amine
CID 114716675

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one (CID 10825717) is 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one is COc1ccccc1Cn1cnc2ncccc2c1=O.
What is the InChIKey of 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is IXCXMBCZCFEYJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-20-13-7-3-2-5-11(13)9-18-10-17-14-12(15(18)19)6-4-8-16-14/h2-8,10H,9H2,1H3.
What are the key properties of 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one?
3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 267.29 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)methyl]pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 10825717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).