1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione

C15H13N3O2 — CID 2826307

IUPAC1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)c2c(-c3ccccc3)ccnc2n(C)c1=O
InChIInChI=1S/C15H13N3O2/c1-17-13-12(14(19)18(2)15(17)20)11(8-9-16-13)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyXOBYICXOKSQCGI-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.30
Rot. Bonds1

About 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione

1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 2826307) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID2826307
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)c2c(-c3ccccc3)ccnc2n(C)c1=O
InChIInChI=1S/C15H13N3O2/c1-17-13-12(14(19)18(2)15(17)20)11(8-9-16-13)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyXOBYICXOKSQCGI-UHFFFAOYSA-N
XLogP1.30
TPSA56.89 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione (CID 2826307) is 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione is Cn1c(=O)c2c(-c3ccccc3)ccnc2n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is XOBYICXOKSQCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-17-13-12(14(19)18(2)15(17)20)11(8-9-16-13)10-6-4-3-5-7-10/h3-9H,1-2H3.
What are the key properties of 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione?
1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 267.29 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-phenylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 2826307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).