6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine

C15H10ClFN2O2 — CID 129316309

IUPAC6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine
SMILESFc1ccc(Cl)cc1Oc1ccc2c(C3CC3)noc2n1
InChIInChI=1S/C15H10ClFN2O2/c16-9-3-5-11(17)12(7-9)20-13-6-4-10-14(8-1-2-8)19-21-15(10)18-13/h3-8H,1-2H2
InChIKeyLEWMTIMRZMKSSG-UHFFFAOYSA-N
MW304.71 g/mol
LogP4.68
Rot. Bonds3

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

6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine (PubChem CID 129316309) has the molecular formula C15H10ClFN2O2 and a molecular weight of 304.71 g/mol. Its IUPAC name is 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine
PubChem CID129316309
Molecular FormulaC15H10ClFN2O2
Molecular Weight304.71 g/mol
Exact Mass304.04
IUPAC Name6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine
SMILESFc1ccc(Cl)cc1Oc1ccc2c(C3CC3)noc2n1
InChIInChI=1S/C15H10ClFN2O2/c16-9-3-5-11(17)12(7-9)20-13-6-4-10-14(8-1-2-8)19-21-15(10)18-13/h3-8H,1-2H2
InChIKeyLEWMTIMRZMKSSG-UHFFFAOYSA-N
XLogP4.68
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.71
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine?
The IUPAC name of 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine (CID 129316309) is 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine?
The canonical SMILES for 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine is Fc1ccc(Cl)cc1Oc1ccc2c(C3CC3)noc2n1.
What is the InChIKey of 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine?
The InChIKey is LEWMTIMRZMKSSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2O2/c16-9-3-5-11(17)12(7-9)20-13-6-4-10-14(8-1-2-8)19-21-15(10)18-13/h3-8H,1-2H2.
What are the key properties of 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine?
6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine has a molecular weight of 304.71 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chloro-2-fluorophenoxy)-3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 129316309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).