5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one

C15H12N4O — CID 135581354

IUPAC5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one
SMILESCc1c(-c2ccncc2)nc(-c2ccncc2)[nH]c1=O
InChIInChI=1S/C15H12N4O/c1-10-13(11-2-6-16-7-3-11)18-14(19-15(10)20)12-4-8-17-9-5-12/h2-9H,1H3,(H,18,19,20)
InChIKeyUSVGDJSOXNLVMK-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.20
Rot. Bonds2

About 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one

5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one (PubChem CID 135581354) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one
PubChem CID135581354
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one
SMILESCc1c(-c2ccncc2)nc(-c2ccncc2)[nH]c1=O
InChIInChI=1S/C15H12N4O/c1-10-13(11-2-6-16-7-3-11)18-14(19-15(10)20)12-4-8-17-9-5-12/h2-9H,1H3,(H,18,19,20)
InChIKeyUSVGDJSOXNLVMK-UHFFFAOYSA-N
XLogP2.20
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-2-phenyl-4-pyridin-4-yl-1H-pyrimidin-6-one
CID 135753934
5-methyl-4-phenyl-2-pyridin-4-yl-1H-pyrimidin-6-one
CID 136764386
2-(3-bromo-2-pyridinyl)-5-methyl-4-phenyl-1H-pyrimidin-6-one
CID 136764381
4-(3-chlorophenyl)-5-methyl-2-phenyl-1H-pyrimidin-6-one
CID 135453967
2-(3-aminophenyl)-5-methyl-4-phenyl-1H-pyrimidin-6-one
CID 136764468
methyl 4-(5-methyl-6-oxo-4-phenyl-1H-pyrimidin-2-yl)benzoate
CID 137316253
methyl 4-(5-methyl-6-oxo-2-phenyl-1H-pyrimidin-4-yl)benzoate
CID 137316255
2-(2-chlorophenyl)-5-methyl-4-phenyl-1H-pyrimidin-6-one
CID 136764407
5-methyl-2-(5-methylfuran-2-yl)-4-phenyl-1H-pyrimidin-6-one
CID 136764434
2-pyridin-4-yl-3H-pteridin-4-one
CID 135932000
4-methyl-2-(4-pyridin-4-ylphenyl)-1H-pyrimidin-6-one
CID 136993255
2-pyridin-4-yl-3H-thieno[2,3-d]pyrimidin-4-one
CID 71068430

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one?
The IUPAC name of 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one (CID 135581354) is 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one?
The canonical SMILES for 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one is Cc1c(-c2ccncc2)nc(-c2ccncc2)[nH]c1=O.
What is the InChIKey of 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one?
The InChIKey is USVGDJSOXNLVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c1-10-13(11-2-6-16-7-3-11)18-14(19-15(10)20)12-4-8-17-9-5-12/h2-9H,1H3,(H,18,19,20).
What are the key properties of 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one?
5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one has a molecular weight of 264.29 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,4-dipyridin-4-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 135581354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).