5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole

C18H11FN4O — CID 10267893

IUPAC5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESFc1ccc(-c2cccnc2)cc1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C18H11FN4O/c19-15-7-6-12(13-4-3-8-20-11-13)10-14(15)18-22-17(23-24-18)16-5-1-2-9-21-16/h1-11H
InChIKeyCGSQBGIBUMJCTB-UHFFFAOYSA-N
MW318.31 g/mol
LogP4.00
Rot. Bonds3

About 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole

5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole (PubChem CID 10267893) has the molecular formula C18H11FN4O and a molecular weight of 318.31 g/mol. Its IUPAC name is 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
PubChem CID10267893
Molecular FormulaC18H11FN4O
Molecular Weight318.31 g/mol
Exact Mass318.09
IUPAC Name5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESFc1ccc(-c2cccnc2)cc1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C18H11FN4O/c19-15-7-6-12(13-4-3-8-20-11-13)10-14(15)18-22-17(23-24-18)16-5-1-2-9-21-16/h1-11H
InChIKeyCGSQBGIBUMJCTB-UHFFFAOYSA-N
XLogP4.00
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.31
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole (CID 10267893) is 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole is Fc1ccc(-c2cccnc2)cc1-c1nc(-c2ccccn2)no1.
What is the InChIKey of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The InChIKey is CGSQBGIBUMJCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN4O/c19-15-7-6-12(13-4-3-8-20-11-13)10-14(15)18-22-17(23-24-18)16-5-1-2-9-21-16/h1-11H.
What are the key properties of 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole has a molecular weight of 318.31 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-5-pyridin-3-ylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 10267893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).