6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine

C7H2F4N2O — CID 82337654

IUPAC6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
SMILESFc1cnc2oc(C(F)(F)F)nc2c1
InChIInChI=1S/C7H2F4N2O/c8-3-1-4-5(12-2-3)14-6(13-4)7(9,10)11/h1-2H
InChIKeyGUPXIJMOVJUAAH-UHFFFAOYSA-N
MW206.10 g/mol
LogP2.38
Rot. Bonds

About 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine

6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine (PubChem CID 82337654) has the molecular formula C7H2F4N2O and a molecular weight of 206.10 g/mol. Its IUPAC name is 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
PubChem CID82337654
Molecular FormulaC7H2F4N2O
Molecular Weight206.10 g/mol
Exact Mass206.01
IUPAC Name6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
SMILESFc1cnc2oc(C(F)(F)F)nc2c1
InChIInChI=1S/C7H2F4N2O/c8-3-1-4-5(12-2-3)14-6(13-4)7(9,10)11/h1-2H
InChIKeyGUPXIJMOVJUAAH-UHFFFAOYSA-N
XLogP2.38
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.10
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The IUPAC name of 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine (CID 82337654) is 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The canonical SMILES for 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine is Fc1cnc2oc(C(F)(F)F)nc2c1.
What is the InChIKey of 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The InChIKey is GUPXIJMOVJUAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2F4N2O/c8-3-1-4-5(12-2-3)14-6(13-4)7(9,10)11/h1-2H.
What are the key properties of 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine has a molecular weight of 206.10 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 82337654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).