3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole

C15H11FN2O2 — CID 141170955

IUPAC3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1cccc(Oc2ccc(Cc3ccon3)cn2)c1
InChIInChI=1S/C15H11FN2O2/c16-12-2-1-3-14(9-12)20-15-5-4-11(10-17-15)8-13-6-7-19-18-13/h1-7,9-10H,8H2
InChIKeyFYPJASIUABRTBJ-UHFFFAOYSA-N
MW270.26 g/mol
LogP3.59
Rot. Bonds4

About 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole

3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole (PubChem CID 141170955) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
PubChem CID141170955
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC Name3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1cccc(Oc2ccc(Cc3ccon3)cn2)c1
InChIInChI=1S/C15H11FN2O2/c16-12-2-1-3-14(9-12)20-15-5-4-11(10-17-15)8-13-6-7-19-18-13/h1-7,9-10H,8H2
InChIKeyFYPJASIUABRTBJ-UHFFFAOYSA-N
XLogP3.59
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The IUPAC name of 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole (CID 141170955) is 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole.
What is the SMILES notation for 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The canonical SMILES for 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole is Fc1cccc(Oc2ccc(Cc3ccon3)cn2)c1.
What is the InChIKey of 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The InChIKey is FYPJASIUABRTBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-12-2-1-3-14(9-12)20-15-5-4-11(10-17-15)8-13-6-7-19-18-13/h1-7,9-10H,8H2.
What are the key properties of 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole has a molecular weight of 270.26 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[6-(3-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole is sourced from PubChem (CID 141170955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).