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

C15H11N3O — CID 137175854

IUPAC2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESO=c1[nH]c(C=Cc2ccccc2)nc2ncccc12
InChIInChI=1S/C15H11N3O/c19-15-12-7-4-10-16-14(12)17-13(18-15)9-8-11-5-2-1-3-6-11/h1-10H,(H,16,17,18,19)
InChIKeyUUGYBJKEPOUNQS-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.49
Rot. Bonds2

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

2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one (PubChem CID 137175854) has the molecular formula C15H11N3O and a molecular weight of 249.27 g/mol. Its IUPAC name is 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one
PubChem CID137175854
Molecular FormulaC15H11N3O
Molecular Weight249.27 g/mol
Exact Mass249.09
IUPAC Name2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESO=c1[nH]c(C=Cc2ccccc2)nc2ncccc12
InChIInChI=1S/C15H11N3O/c19-15-12-7-4-10-16-14(12)17-13(18-15)9-8-11-5-2-1-3-6-11/h1-10H,(H,16,17,18,19)
InChIKeyUUGYBJKEPOUNQS-UHFFFAOYSA-N
XLogP2.49
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(E)-2-(4-fluorophenyl)ethenyl]-3H-pyrido[2,3-d]pyrimidin-4-one
CID 136721366
2-[2-(4-ethylphenyl)ethenyl]-3H-quinazolin-4-one
CID 135517947
4-oxo-3H-pyrido[2,3-d]pyrimidine-2-carbonitrile
CID 137211979
2-[(E)-2-(4-nitrophenyl)ethenyl]-3H-quinazolin-4-one
CID 135446762
2-(3-phenoxypropoxy)-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135899320
2-[(E)-2-(3,4-difluorophenyl)ethenyl]-3H-quinazolin-4-one
CID 136721364
2-(2-naphthalen-1-ylethenyl)-3H-quinazolin-4-one
CID 135471735
2-(naphthalen-1-yloxymethyl)-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135899276
5,6-dimethyl-2-[(E)-2-phenylethenyl]-3H-thieno[2,3-d]pyrimidin-4-one
CID 13492244
2-[2-(2-aminophenyl)ethenyl]-3H-quinazolin-4-one
CID 137193134
2-[(2-chlorophenoxy)methyl]-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135899274
2-[2-(4-ethoxy-3-methoxyphenyl)ethenyl]-3H-quinazolin-4-one
CID 135413589

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one (CID 137175854) is 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one is O=c1[nH]c(C=Cc2ccccc2)nc2ncccc12.
What is the InChIKey of 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is UUGYBJKEPOUNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O/c19-15-12-7-4-10-16-14(12)17-13(18-15)9-8-11-5-2-1-3-6-11/h1-10H,(H,16,17,18,19).
What are the key properties of 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one?
2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 249.27 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethenyl)-3H-pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 137175854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).