3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole

C11H8FN5O2 — CID 118962880

IUPAC3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole
SMILESCOc1nc(-c2cc(-c3ccon3)n[nH]2)ncc1F
InChIInChI=1S/C11H8FN5O2/c1-18-11-6(12)5-13-10(14-11)9-4-8(15-16-9)7-2-3-19-17-7/h2-5H,1H3,(H,15,16)
InChIKeyZMCYUTVYHWHXNS-UHFFFAOYSA-N
MW261.22 g/mol
LogP1.67
Rot. Bonds3

About 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole

3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole (PubChem CID 118962880) has the molecular formula C11H8FN5O2 and a molecular weight of 261.22 g/mol. Its IUPAC name is 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole.

Molecular Properties

Compound Name3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole
PubChem CID118962880
Molecular FormulaC11H8FN5O2
Molecular Weight261.22 g/mol
Exact Mass261.07
IUPAC Name3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole
SMILESCOc1nc(-c2cc(-c3ccon3)n[nH]2)ncc1F
InChIInChI=1S/C11H8FN5O2/c1-18-11-6(12)5-13-10(14-11)9-4-8(15-16-9)7-2-3-19-17-7/h2-5H,1H3,(H,15,16)
InChIKeyZMCYUTVYHWHXNS-UHFFFAOYSA-N
XLogP1.67
TPSA89.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole 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 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole?
The IUPAC name of 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole (CID 118962880) is 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole.
What is the SMILES notation for 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole?
The canonical SMILES for 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole is COc1nc(-c2cc(-c3ccon3)n[nH]2)ncc1F.
What is the InChIKey of 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole?
The InChIKey is ZMCYUTVYHWHXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN5O2/c1-18-11-6(12)5-13-10(14-11)9-4-8(15-16-9)7-2-3-19-17-7/h2-5H,1H3,(H,15,16).
What are the key properties of 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole?
3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole has a molecular weight of 261.22 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(5-fluoro-4-methoxypyrimidin-2-yl)-1H-pyrazol-3-yl]-1,2-oxazole is sourced from PubChem (CID 118962880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).