5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole

C17H14FNO3 — CID 166147742

IUPAC5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole
SMILESCOc1ccc(COc2cccc(F)c2-c2ccno2)cc1
InChIInChI=1S/C17H14FNO3/c1-20-13-7-5-12(6-8-13)11-21-15-4-2-3-14(18)17(15)16-9-10-19-22-16/h2-10H,11H2,1H3
InChIKeyFQPJTXGFEWHTKX-UHFFFAOYSA-N
MW299.30 g/mol
LogP4.07
Rot. Bonds5

About 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole

5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole (PubChem CID 166147742) has the molecular formula C17H14FNO3 and a molecular weight of 299.30 g/mol. Its IUPAC name is 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole.

Molecular Properties

Compound Name5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole
PubChem CID166147742
Molecular FormulaC17H14FNO3
Molecular Weight299.30 g/mol
Exact Mass299.10
IUPAC Name5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole
SMILESCOc1ccc(COc2cccc(F)c2-c2ccno2)cc1
InChIInChI=1S/C17H14FNO3/c1-20-13-7-5-12(6-8-13)11-21-15-4-2-3-14(18)17(15)16-9-10-19-22-16/h2-10H,11H2,1H3
InChIKeyFQPJTXGFEWHTKX-UHFFFAOYSA-N
XLogP4.07
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.30
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole?
The IUPAC name of 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole (CID 166147742) is 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole.
What is the SMILES notation for 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole?
The canonical SMILES for 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole is COc1ccc(COc2cccc(F)c2-c2ccno2)cc1.
What is the InChIKey of 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole?
The InChIKey is FQPJTXGFEWHTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO3/c1-20-13-7-5-12(6-8-13)11-21-15-4-2-3-14(18)17(15)16-9-10-19-22-16/h2-10H,11H2,1H3.
What are the key properties of 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole?
5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole has a molecular weight of 299.30 g/mol, XLogP of 4.07, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole is sourced from PubChem (CID 166147742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).