4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine

C21H12F3N3O2 — CID 146025723

IUPAC4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine
SMILESFC(F)(F)c1cc(-c2cccc3nccn23)ccc1Oc1nccc2occc12
InChIInChI=1S/C21H12F3N3O2/c22-21(23,24)15-12-13(16-2-1-3-19-25-9-10-27(16)19)4-5-18(15)29-20-14-7-11-28-17(14)6-8-26-20/h1-12H
InChIKeyFLAVEDFNCPZACM-UHFFFAOYSA-N
MW395.34 g/mol
LogP5.95
Rot. Bonds3

About 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine

4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine (PubChem CID 146025723) has the molecular formula C21H12F3N3O2 and a molecular weight of 395.34 g/mol. Its IUPAC name is 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine.

Molecular Properties

Compound Name4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine
PubChem CID146025723
Molecular FormulaC21H12F3N3O2
Molecular Weight395.34 g/mol
Exact Mass395.09
IUPAC Name4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine
SMILESFC(F)(F)c1cc(-c2cccc3nccn23)ccc1Oc1nccc2occc12
InChIInChI=1S/C21H12F3N3O2/c22-21(23,24)15-12-13(16-2-1-3-19-25-9-10-27(16)19)4-5-18(15)29-20-14-7-11-28-17(14)6-8-26-20/h1-12H
InChIKeyFLAVEDFNCPZACM-UHFFFAOYSA-N
XLogP5.95
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.34
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine?
The IUPAC name of 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine (CID 146025723) is 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine.
What is the SMILES notation for 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine?
The canonical SMILES for 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine is FC(F)(F)c1cc(-c2cccc3nccn23)ccc1Oc1nccc2occc12.
What is the InChIKey of 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine?
The InChIKey is FLAVEDFNCPZACM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H12F3N3O2/c22-21(23,24)15-12-13(16-2-1-3-19-25-9-10-27(16)19)4-5-18(15)29-20-14-7-11-28-17(14)6-8-26-20/h1-12H.
What are the key properties of 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine?
4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine has a molecular weight of 395.34 g/mol, XLogP of 5.95, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-imidazo[1,2-a]pyridin-5-yl-2-(trifluoromethyl)phenoxy]furo[3,2-c]pyridine is sourced from PubChem (CID 146025723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).