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

C8H5FN2O — CID 83129545

IUPAC5-(5-fluoro-2-pyridinyl)-1,2-oxazole
SMILESFc1ccc(-c2ccno2)nc1
InChIInChI=1S/C8H5FN2O/c9-6-1-2-7(10-5-6)8-3-4-11-12-8/h1-5H
InChIKeyTXDKEFPBGJYDDQ-UHFFFAOYSA-N
MW164.14 g/mol
LogP1.88
Rot. Bonds1

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

5-(5-fluoro-2-pyridinyl)-1,2-oxazole (PubChem CID 83129545) has the molecular formula C8H5FN2O and a molecular weight of 164.14 g/mol. Its IUPAC name is 5-(5-fluoro-2-pyridinyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(5-fluoro-2-pyridinyl)-1,2-oxazole
PubChem CID83129545
Molecular FormulaC8H5FN2O
Molecular Weight164.14 g/mol
Exact Mass164.04
IUPAC Name5-(5-fluoro-2-pyridinyl)-1,2-oxazole
SMILESFc1ccc(-c2ccno2)nc1
InChIInChI=1S/C8H5FN2O/c9-6-1-2-7(10-5-6)8-3-4-11-12-8/h1-5H
InChIKeyTXDKEFPBGJYDDQ-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

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Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-2-pyridinyl)-1,2-oxazole?
The IUPAC name of 5-(5-fluoro-2-pyridinyl)-1,2-oxazole (CID 83129545) is 5-(5-fluoro-2-pyridinyl)-1,2-oxazole.
What is the SMILES notation for 5-(5-fluoro-2-pyridinyl)-1,2-oxazole?
The canonical SMILES for 5-(5-fluoro-2-pyridinyl)-1,2-oxazole is Fc1ccc(-c2ccno2)nc1.
What is the InChIKey of 5-(5-fluoro-2-pyridinyl)-1,2-oxazole?
The InChIKey is TXDKEFPBGJYDDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O/c9-6-1-2-7(10-5-6)8-3-4-11-12-8/h1-5H.
What are the key properties of 5-(5-fluoro-2-pyridinyl)-1,2-oxazole?
5-(5-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-(5-fluoro-2-pyridinyl)-1,2-oxazole is sourced from PubChem (CID 83129545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).