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

C12H6F2N2O — CID 3040487

IUPAC2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine
SMILESFc1cccc(F)c1-c1nc2ncccc2o1
InChIInChI=1S/C12H6F2N2O/c13-7-3-1-4-8(14)10(7)12-16-11-9(17-12)5-2-6-15-11/h1-6H
InChIKeyWSYUPTNOAZFFGN-UHFFFAOYSA-N
MW232.19 g/mol
LogP3.17
Rot. Bonds1

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

2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 3040487) has the molecular formula C12H6F2N2O and a molecular weight of 232.19 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine
PubChem CID3040487
Molecular FormulaC12H6F2N2O
Molecular Weight232.19 g/mol
Exact Mass232.04
IUPAC Name2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine
SMILESFc1cccc(F)c1-c1nc2ncccc2o1
InChIInChI=1S/C12H6F2N2O/c13-7-3-1-4-8(14)10(7)12-16-11-9(17-12)5-2-6-15-11/h1-6H
InChIKeyWSYUPTNOAZFFGN-UHFFFAOYSA-N
XLogP3.17
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.19
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine (CID 3040487) is 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine is Fc1cccc(F)c1-c1nc2ncccc2o1.
What is the InChIKey of 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is WSYUPTNOAZFFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F2N2O/c13-7-3-1-4-8(14)10(7)12-16-11-9(17-12)5-2-6-15-11/h1-6H.
What are the key properties of 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine?
2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 232.19 g/mol, XLogP of 3.17, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 3040487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).