2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine

C16H14FN3O — CID 117166582

IUPAC2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
SMILESFc1cccc(-c2nc3cccnc3n2C2CCOC2)c1
InChIInChI=1S/C16H14FN3O/c17-12-4-1-3-11(9-12)15-19-14-5-2-7-18-16(14)20(15)13-6-8-21-10-13/h1-5,7,9,13H,6,8,10H2
InChIKeyJFXGCIMYKJKGIF-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.20
Rot. Bonds2

About 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine

2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine (PubChem CID 117166582) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
PubChem CID117166582
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
SMILESFc1cccc(-c2nc3cccnc3n2C2CCOC2)c1
InChIInChI=1S/C16H14FN3O/c17-12-4-1-3-11(9-12)15-19-14-5-2-7-18-16(14)20(15)13-6-8-21-10-13/h1-5,7,9,13H,6,8,10H2
InChIKeyJFXGCIMYKJKGIF-UHFFFAOYSA-N
XLogP3.20
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine (CID 117166582) is 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine is Fc1cccc(-c2nc3cccnc3n2C2CCOC2)c1.
What is the InChIKey of 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine?
The InChIKey is JFXGCIMYKJKGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-12-4-1-3-11(9-12)15-19-14-5-2-7-18-16(14)20(15)13-6-8-21-10-13/h1-5,7,9,13H,6,8,10H2.
What are the key properties of 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine?
2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine has a molecular weight of 283.31 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-3-(oxolan-3-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117166582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).