5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole

C11H10FNO2 — CID 60681199

IUPAC5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole
SMILESCc1cc(COc2cccc(F)c2)on1
InChIInChI=1S/C11H10FNO2/c1-8-5-11(15-13-8)7-14-10-4-2-3-9(12)6-10/h2-6H,7H2,1H3
InChIKeyPYNQAQVLZPVTEU-UHFFFAOYSA-N
MW207.20 g/mol
LogP2.70
Rot. Bonds3

About 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole

5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole (PubChem CID 60681199) has the molecular formula C11H10FNO2 and a molecular weight of 207.20 g/mol. Its IUPAC name is 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole.

Molecular Properties

Compound Name5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole
PubChem CID60681199
Molecular FormulaC11H10FNO2
Molecular Weight207.20 g/mol
Exact Mass207.07
IUPAC Name5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole
SMILESCc1cc(COc2cccc(F)c2)on1
InChIInChI=1S/C11H10FNO2/c1-8-5-11(15-13-8)7-14-10-4-2-3-9(12)6-10/h2-6H,7H2,1H3
InChIKeyPYNQAQVLZPVTEU-UHFFFAOYSA-N
XLogP2.70
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole?
The IUPAC name of 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole (CID 60681199) is 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole.
What is the SMILES notation for 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole?
The canonical SMILES for 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole is Cc1cc(COc2cccc(F)c2)on1.
What is the InChIKey of 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole?
The InChIKey is PYNQAQVLZPVTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2/c1-8-5-11(15-13-8)7-14-10-4-2-3-9(12)6-10/h2-6H,7H2,1H3.
What are the key properties of 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole?
5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole has a molecular weight of 207.20 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole is sourced from PubChem (CID 60681199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).