5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione

C14H11N3O4 — CID 54677776

IUPAC5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCn1c(=O)c2c(O)cc(=O)[nH]c2n(-c2ccccc2)c1=O
InChIInChI=1S/C14H11N3O4/c1-16-13(20)11-9(18)7-10(19)15-12(11)17(14(16)21)8-5-3-2-4-6-8/h2-7H,1H3,(H2,15,18,19)
InChIKeyQEBPYBNSHXLFJK-UHFFFAOYSA-N
MW285.26 g/mol
LogP0.08
Rot. Bonds1

About 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione

5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione (PubChem CID 54677776) has the molecular formula C14H11N3O4 and a molecular weight of 285.26 g/mol. Its IUPAC name is 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione.

Molecular Properties

Compound Name5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione
PubChem CID54677776
Molecular FormulaC14H11N3O4
Molecular Weight285.26 g/mol
Exact Mass285.07
IUPAC Name5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione
SMILESCn1c(=O)c2c(O)cc(=O)[nH]c2n(-c2ccccc2)c1=O
InChIInChI=1S/C14H11N3O4/c1-16-13(20)11-9(18)7-10(19)15-12(11)17(14(16)21)8-5-3-2-4-6-8/h2-7H,1H3,(H2,15,18,19)
InChIKeyQEBPYBNSHXLFJK-UHFFFAOYSA-N
XLogP0.08
TPSA97.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.26
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione?
The IUPAC name of 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione (CID 54677776) is 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione.
What is the SMILES notation for 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione?
The canonical SMILES for 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione is Cn1c(=O)c2c(O)cc(=O)[nH]c2n(-c2ccccc2)c1=O.
What is the InChIKey of 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione?
The InChIKey is QEBPYBNSHXLFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O4/c1-16-13(20)11-9(18)7-10(19)15-12(11)17(14(16)21)8-5-3-2-4-6-8/h2-7H,1H3,(H2,15,18,19).
What are the key properties of 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione?
5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione has a molecular weight of 285.26 g/mol, XLogP of 0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione is sourced from PubChem (CID 54677776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).