2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one

C15H13N3O2 — CID 135670755

IUPAC2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one
SMILESCCOc1ccccc1-c1nc2cccnc2c(=O)[nH]1
InChIInChI=1S/C15H13N3O2/c1-2-20-12-8-4-3-6-10(12)14-17-11-7-5-9-16-13(11)15(19)18-14/h3-9H,2H2,1H3,(H,17,18,19)
InChIKeyAOYNQNYYBAQOSF-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.38
Rot. Bonds3

About 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one

2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one (PubChem CID 135670755) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one
PubChem CID135670755
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one
SMILESCCOc1ccccc1-c1nc2cccnc2c(=O)[nH]1
InChIInChI=1S/C15H13N3O2/c1-2-20-12-8-4-3-6-10(12)14-17-11-7-5-9-16-13(11)15(19)18-14/h3-9H,2H2,1H3,(H,17,18,19)
InChIKeyAOYNQNYYBAQOSF-UHFFFAOYSA-N
XLogP2.38
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyphenyl)-8-methoxy-3H-quinazolin-4-one
CID 135966513
2-(2-propoxyphenyl)-3H-pteridin-4-one
CID 135670793
6-(2-propoxyphenyl)-7H-pyrimido[5,4-d]pyrimidin-8-one
CID 135559157
2-(2-ethoxy-5-fluorophenyl)-3H-quinazolin-4-one
CID 168551059
2-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one
CID 137012915
2-(2-ethoxyphenyl)-4-methyl-1H-benzimidazole
CID 60646509
2-(2-ethoxyphenyl)-5,7-dimethyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one
CID 135443738
2-[2-(2,2-difluoroethoxy)phenyl]-3H-quinazolin-4-one
CID 168552669
2-(2-ethoxy-5-nitrophenyl)-3H-quinazolin-4-one
CID 139685445
2-(2-butan-2-yloxyphenyl)-3H-quinazolin-4-one
CID 168552014
2-(2-ethoxyphenyl)-7-ethyl-5-methyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one
CID 136862825
2-(4-ethoxy-3-methylphenyl)-3H-quinazolin-4-one
CID 168551046

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one?
The IUPAC name of 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one (CID 135670755) is 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one.
What is the SMILES notation for 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one?
The canonical SMILES for 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one is CCOc1ccccc1-c1nc2cccnc2c(=O)[nH]1.
What is the InChIKey of 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one?
The InChIKey is AOYNQNYYBAQOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-2-20-12-8-4-3-6-10(12)14-17-11-7-5-9-16-13(11)15(19)18-14/h3-9H,2H2,1H3,(H,17,18,19).
What are the key properties of 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one?
2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one has a molecular weight of 267.29 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one is sourced from PubChem (CID 135670755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).