3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine

C13H8F3N3 — CID 67191628

IUPAC3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1cnc2c(c1)ncn2-c1ccccc1
InChIInChI=1S/C13H8F3N3/c14-13(15,16)9-6-11-12(17-7-9)19(8-18-11)10-4-2-1-3-5-10/h1-8H
InChIKeyMGVXZQQVMMQTPA-UHFFFAOYSA-N
MW263.22 g/mol
LogP3.44
Rot. Bonds1

About 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine

3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine (PubChem CID 67191628) has the molecular formula C13H8F3N3 and a molecular weight of 263.22 g/mol. Its IUPAC name is 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
PubChem CID67191628
Molecular FormulaC13H8F3N3
Molecular Weight263.22 g/mol
Exact Mass263.07
IUPAC Name3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1cnc2c(c1)ncn2-c1ccccc1
InChIInChI=1S/C13H8F3N3/c14-13(15,16)9-6-11-12(17-7-9)19(8-18-11)10-4-2-1-3-5-10/h1-8H
InChIKeyMGVXZQQVMMQTPA-UHFFFAOYSA-N
XLogP3.44
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine (CID 67191628) is 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine is FC(F)(F)c1cnc2c(c1)ncn2-c1ccccc1.
What is the InChIKey of 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?
The InChIKey is MGVXZQQVMMQTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F3N3/c14-13(15,16)9-6-11-12(17-7-9)19(8-18-11)10-4-2-1-3-5-10/h1-8H.
What are the key properties of 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?
3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine has a molecular weight of 263.22 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 67191628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).