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

C7H3F3N2O — CID 130116195

IUPAC5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
SMILESFC(F)(F)c1ccc2ncoc2n1
InChIInChI=1S/C7H3F3N2O/c8-7(9,10)5-2-1-4-6(12-5)13-3-11-4/h1-3H
InChIKeyXPTUCWQMYLJKQL-UHFFFAOYSA-N
MW188.11 g/mol
LogP2.24
Rot. Bonds

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

5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine (PubChem CID 130116195) has the molecular formula C7H3F3N2O and a molecular weight of 188.11 g/mol. Its IUPAC name is 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
PubChem CID130116195
Molecular FormulaC7H3F3N2O
Molecular Weight188.11 g/mol
Exact Mass188.02
IUPAC Name5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
SMILESFC(F)(F)c1ccc2ncoc2n1
InChIInChI=1S/C7H3F3N2O/c8-7(9,10)5-2-1-4-6(12-5)13-3-11-4/h1-3H
InChIKeyXPTUCWQMYLJKQL-UHFFFAOYSA-N
XLogP2.24
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.11
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-Difluorophenyl)-[1,3]oxazolo[5,4-b]pyridine
CID 12461424
2-Chlorooxazolo[5,4-b]pyridine
CID 57370272
2-(5-Isothiocyanato-2-pyridinyl)-1,3-benzoxazole
CID 44384774
(1,3)Oxazolo(5,4-b)pyridine
CID 19831830
2-Methyloxazolo[5,4-b]pyridine
CID 13260645
6-Bromo-[1,3]oxazolo[5,4-b]pyridine
CID 55252641
5-Chloro-[1,3]oxazolo[5,4-b]pyridine
CID 72214753
2-Chloro-6-fluorooxazolo[5,4-b]pyridine
CID 129919818
2-(Methylthio)oxazolo[5,4-b]pyridine
CID 10419535
5-Methyloxazolopyridine
CID 58957242
2-Phenyl-5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine
CID 22754815
5,7-Difluoro-1,3-benzoxazole
CID 45090611

Frequently Asked Questions

What is the IUPAC name of 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The IUPAC name of 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine (CID 130116195) is 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The canonical SMILES for 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine is FC(F)(F)c1ccc2ncoc2n1.
What is the InChIKey of 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
The InChIKey is XPTUCWQMYLJKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3F3N2O/c8-7(9,10)5-2-1-4-6(12-5)13-3-11-4/h1-3H.
What are the key properties of 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine?
5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine has a molecular weight of 188.11 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(trifluoromethyl)-[1,3]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 130116195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).