2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine

C12H6F3N3 — CID 65100220

IUPAC2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine
SMILESFc1cc(F)c(-c2nc3ncccc3[nH]2)c(F)c1
InChIInChI=1S/C12H6F3N3/c13-6-4-7(14)10(8(15)5-6)12-17-9-2-1-3-16-11(9)18-12/h1-5H,(H,16,17,18)
InChIKeyUNHITQMEHQRKJJ-UHFFFAOYSA-N
MW249.20 g/mol
LogP3.04
Rot. Bonds1

About 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine

2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 65100220) has the molecular formula C12H6F3N3 and a molecular weight of 249.20 g/mol. Its IUPAC name is 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID65100220
Molecular FormulaC12H6F3N3
Molecular Weight249.20 g/mol
Exact Mass249.05
IUPAC Name2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine
SMILESFc1cc(F)c(-c2nc3ncccc3[nH]2)c(F)c1
InChIInChI=1S/C12H6F3N3/c13-6-4-7(14)10(8(15)5-6)12-17-9-2-1-3-16-11(9)18-12/h1-5H,(H,16,17,18)
InChIKeyUNHITQMEHQRKJJ-UHFFFAOYSA-N
XLogP3.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.20
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine (CID 65100220) is 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine is Fc1cc(F)c(-c2nc3ncccc3[nH]2)c(F)c1.
What is the InChIKey of 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is UNHITQMEHQRKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F3N3/c13-6-4-7(14)10(8(15)5-6)12-17-9-2-1-3-16-11(9)18-12/h1-5H,(H,16,17,18).
What are the key properties of 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine?
2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 249.20 g/mol, XLogP of 3.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,6-trifluorophenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 65100220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).