2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole

C17H12FN5O2 — CID 154833995

IUPAC2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole
SMILESFc1ccccc1-c1nnc(CCc2nc(-c3ccccn3)no2)o1
InChIInChI=1S/C17H12FN5O2/c18-12-6-2-1-5-11(12)17-22-21-15(24-17)9-8-14-20-16(23-25-14)13-7-3-4-10-19-13/h1-7,10H,8-9H2
InChIKeyVFEUGVABJXYISI-UHFFFAOYSA-N
MW337.31 g/mol
LogP3.11
Rot. Bonds5

About 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole

2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole (PubChem CID 154833995) has the molecular formula C17H12FN5O2 and a molecular weight of 337.31 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole
PubChem CID154833995
Molecular FormulaC17H12FN5O2
Molecular Weight337.31 g/mol
Exact Mass337.10
IUPAC Name2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole
SMILESFc1ccccc1-c1nnc(CCc2nc(-c3ccccn3)no2)o1
InChIInChI=1S/C17H12FN5O2/c18-12-6-2-1-5-11(12)17-22-21-15(24-17)9-8-14-20-16(23-25-14)13-7-3-4-10-19-13/h1-7,10H,8-9H2
InChIKeyVFEUGVABJXYISI-UHFFFAOYSA-N
XLogP3.11
TPSA90.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.31
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole?
The IUPAC name of 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole (CID 154833995) is 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole is Fc1ccccc1-c1nnc(CCc2nc(-c3ccccn3)no2)o1.
What is the InChIKey of 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole?
The InChIKey is VFEUGVABJXYISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN5O2/c18-12-6-2-1-5-11(12)17-22-21-15(24-17)9-8-14-20-16(23-25-14)13-7-3-4-10-19-13/h1-7,10H,8-9H2.
What are the key properties of 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole?
2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole has a molecular weight of 337.31 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5-[2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazole is sourced from PubChem (CID 154833995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).