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

C14H12N4O3 — CID 14616443

IUPAC7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
SMILESCn1c(=O)c2c(=O)cc(N)[nH]c2n(-c2ccccc2)c1=O
InChIInChI=1S/C14H12N4O3/c1-17-13(20)11-9(19)7-10(15)16-12(11)18(14(17)21)8-5-3-2-4-6-8/h2-7H,1H3,(H3,15,16,19)
InChIKeyQFHPILKKLOOIEE-UHFFFAOYSA-N
MW284.27 g/mol
LogP-0.04
Rot. Bonds1

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

7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione (PubChem CID 14616443) has the molecular formula C14H12N4O3 and a molecular weight of 284.27 g/mol. Its IUPAC name is 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione.

Molecular Properties

Compound Name7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
PubChem CID14616443
Molecular FormulaC14H12N4O3
Molecular Weight284.27 g/mol
Exact Mass284.09
IUPAC Name7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione
SMILESCn1c(=O)c2c(=O)cc(N)[nH]c2n(-c2ccccc2)c1=O
InChIInChI=1S/C14H12N4O3/c1-17-13(20)11-9(19)7-10(15)16-12(11)18(14(17)21)8-5-3-2-4-6-8/h2-7H,1H3,(H3,15,16,19)
InChIKeyQFHPILKKLOOIEE-UHFFFAOYSA-N
XLogP-0.04
TPSA102.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The IUPAC name of 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione (CID 14616443) is 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione.
What is the SMILES notation for 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The canonical SMILES for 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione is Cn1c(=O)c2c(=O)cc(N)[nH]c2n(-c2ccccc2)c1=O.
What is the InChIKey of 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
The InChIKey is QFHPILKKLOOIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O3/c1-17-13(20)11-9(19)7-10(15)16-12(11)18(14(17)21)8-5-3-2-4-6-8/h2-7H,1H3,(H3,15,16,19).
What are the key properties of 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione?
7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione has a molecular weight of 284.27 g/mol, XLogP of -0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-3-methyl-1-phenyl-8H-pyrido[2,3-d]pyrimidine-2,4,5-trione is sourced from PubChem (CID 14616443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).