4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one

C13H10N4O2 — CID 136795513

IUPAC4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one
SMILESCc1cc(-c2cc(=O)[nH]c(-c3ccccn3)n2)no1
InChIInChI=1S/C13H10N4O2/c1-8-6-11(17-19-8)10-7-12(18)16-13(15-10)9-4-2-3-5-14-9/h2-7H,1H3,(H,15,16,18)
InChIKeyVTWIPPRUGUBKKT-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.80
Rot. Bonds2

About 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one

4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one (PubChem CID 136795513) has the molecular formula C13H10N4O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one
PubChem CID136795513
Molecular FormulaC13H10N4O2
Molecular Weight254.25 g/mol
Exact Mass254.08
IUPAC Name4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one
SMILESCc1cc(-c2cc(=O)[nH]c(-c3ccccn3)n2)no1
InChIInChI=1S/C13H10N4O2/c1-8-6-11(17-19-8)10-7-12(18)16-13(15-10)9-4-2-3-5-14-9/h2-7H,1H3,(H,15,16,18)
InChIKeyVTWIPPRUGUBKKT-UHFFFAOYSA-N
XLogP1.80
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one (CID 136795513) is 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one is Cc1cc(-c2cc(=O)[nH]c(-c3ccccn3)n2)no1.
What is the InChIKey of 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one?
The InChIKey is VTWIPPRUGUBKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O2/c1-8-6-11(17-19-8)10-7-12(18)16-13(15-10)9-4-2-3-5-14-9/h2-7H,1H3,(H,15,16,18).
What are the key properties of 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one?
4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one has a molecular weight of 254.25 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 136795513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).