3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole

C15H11FN2O2 — CID 141170982

IUPAC3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1ccc(Oc2ccc(Cc3ccon3)cn2)cc1
InChIInChI=1S/C15H11FN2O2/c16-12-2-4-14(5-3-12)20-15-6-1-11(10-17-15)9-13-7-8-19-18-13/h1-8,10H,9H2
InChIKeyUQEIAQYEDZJAOM-UHFFFAOYSA-N
MW270.26 g/mol
LogP3.59
Rot. Bonds4

About 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole

3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole (PubChem CID 141170982) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
PubChem CID141170982
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC Name3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1ccc(Oc2ccc(Cc3ccon3)cn2)cc1
InChIInChI=1S/C15H11FN2O2/c16-12-2-4-14(5-3-12)20-15-6-1-11(10-17-15)9-13-7-8-19-18-13/h1-8,10H,9H2
InChIKeyUQEIAQYEDZJAOM-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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Related Compounds

3-Cyclobutyl-7-{[5-(3,5-dimethyl-4-isoxazolyl)-2-pyridinyl]oxy}-2,3,4,5-tetrahydro-1H-3-benzazepine
CID 9977652
3-(4-Fluorophenyl)-4-pyridin-4-yl-1,2-oxazole
CID 9816180
1-[4-({5-nitropyridin-2-yl}oxy)phenyl]-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
CID 818769
6-[3-(4-Fluoro-phenyl)-5-methyl-isoxazol-4-ylmethoxy]-N-isopropyl-nicotinamide
CID 42629329
6-[3-(2-Fluoro-4-methyl-phenyl)-5-methyl-isoxazol-4-ylmethoxy]-N-isopropyl-nicotinamide
CID 57520477
3-(Furan-2-yl)-4-(6-methoxy-3-pyridinyl)-5-phenyl-1,2-oxazole
CID 24761345
3-[4-[[2-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-pyridinyl]methoxy]-2-fluorophenyl]propanoic acid
CID 127046667
CYP11B1 Inhibitor C25
CID 132585204
4-(4-Fluorophenyl)-3-pyridin-4-yl-1,2-oxazole
CID 49823286
4-Benzyloxy-2-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine
CID 42629071
2-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-N-(2,2,2-trifluoro-ethyl)-isonicotinamide
CID 42629072
6-[3-(2-Fluoro-phenyl)-5-methyl-isoxazol-4-ylmethoxy]-N-(2,2,3,3,3-pentafluoro-propyl)-nicotinamide
CID 42629075

Frequently Asked Questions

What is the IUPAC name of 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The IUPAC name of 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole (CID 141170982) is 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole.
What is the SMILES notation for 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The canonical SMILES for 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole is Fc1ccc(Oc2ccc(Cc3ccon3)cn2)cc1.
What is the InChIKey of 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
The InChIKey is UQEIAQYEDZJAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-12-2-4-14(5-3-12)20-15-6-1-11(10-17-15)9-13-7-8-19-18-13/h1-8,10H,9H2.
What are the key properties of 3-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole?
3-[[6-(4-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-(4-fluorophenoxy)-3-pyridinyl]methyl]-1,2-oxazole is sourced from PubChem (CID 141170982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).