4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole

C15H9FN4O — CID 23647329

IUPAC4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole
SMILESFc1ccc(-c2ncoc2-c2ccc3nncn3c2)cc1
InChIInChI=1S/C15H9FN4O/c16-12-4-1-10(2-5-12)14-15(21-9-17-14)11-3-6-13-19-18-8-20(13)7-11/h1-9H
InChIKeyQYSDYIKAMYSXRZ-UHFFFAOYSA-N
MW280.26 g/mol
LogP3.19
Rot. Bonds2

About 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole

4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole (PubChem CID 23647329) has the molecular formula C15H9FN4O and a molecular weight of 280.26 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole
PubChem CID23647329
Molecular FormulaC15H9FN4O
Molecular Weight280.26 g/mol
Exact Mass280.08
IUPAC Name4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole
SMILESFc1ccc(-c2ncoc2-c2ccc3nncn3c2)cc1
InChIInChI=1S/C15H9FN4O/c16-12-4-1-10(2-5-12)14-15(21-9-17-14)11-3-6-13-19-18-8-20(13)7-11/h1-9H
InChIKeyQYSDYIKAMYSXRZ-UHFFFAOYSA-N
XLogP3.19
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.26
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole?
The IUPAC name of 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole (CID 23647329) is 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole.
What is the SMILES notation for 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole?
The canonical SMILES for 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole is Fc1ccc(-c2ncoc2-c2ccc3nncn3c2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole?
The InChIKey is QYSDYIKAMYSXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9FN4O/c16-12-4-1-10(2-5-12)14-15(21-9-17-14)11-3-6-13-19-18-8-20(13)7-11/h1-9H.
What are the key properties of 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole?
4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole has a molecular weight of 280.26 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,3-oxazole is sourced from PubChem (CID 23647329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).