5-(6-fluoro-2-pyridinyl)-1,2-oxazole

C8H5FN2O — CID 177237438

IUPAC5-(6-fluoro-2-pyridinyl)-1,2-oxazole
SMILESFc1cccc(-c2ccno2)n1
InChIInChI=1S/C8H5FN2O/c9-8-3-1-2-6(11-8)7-4-5-10-12-7/h1-5H
InChIKeyFWZAKAZUOSHDTQ-UHFFFAOYSA-N
MW164.14 g/mol
LogP1.88
Rot. Bonds1

About 5-(6-fluoro-2-pyridinyl)-1,2-oxazole

5-(6-fluoro-2-pyridinyl)-1,2-oxazole (PubChem CID 177237438) has the molecular formula C8H5FN2O and a molecular weight of 164.14 g/mol. Its IUPAC name is 5-(6-fluoro-2-pyridinyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(6-fluoro-2-pyridinyl)-1,2-oxazole
PubChem CID177237438
Molecular FormulaC8H5FN2O
Molecular Weight164.14 g/mol
Exact Mass164.04
IUPAC Name5-(6-fluoro-2-pyridinyl)-1,2-oxazole
SMILESFc1cccc(-c2ccno2)n1
InChIInChI=1S/C8H5FN2O/c9-8-3-1-2-6(11-8)7-4-5-10-12-7/h1-5H
InChIKeyFWZAKAZUOSHDTQ-UHFFFAOYSA-N
XLogP1.88
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.14
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoro-2-pyridinyl)-1,2-oxazole?
The IUPAC name of 5-(6-fluoro-2-pyridinyl)-1,2-oxazole (CID 177237438) is 5-(6-fluoro-2-pyridinyl)-1,2-oxazole.
What is the SMILES notation for 5-(6-fluoro-2-pyridinyl)-1,2-oxazole?
The canonical SMILES for 5-(6-fluoro-2-pyridinyl)-1,2-oxazole is Fc1cccc(-c2ccno2)n1.
What is the InChIKey of 5-(6-fluoro-2-pyridinyl)-1,2-oxazole?
The InChIKey is FWZAKAZUOSHDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O/c9-8-3-1-2-6(11-8)7-4-5-10-12-7/h1-5H.
What are the key properties of 5-(6-fluoro-2-pyridinyl)-1,2-oxazole?
5-(6-fluoro-2-pyridinyl)-1,2-oxazole has a molecular weight of 164.14 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoro-2-pyridinyl)-1,2-oxazole is sourced from PubChem (CID 177237438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).