2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine

C14H9F4N3 — CID 79791283

IUPAC2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3ccc(F)c(C(F)(F)F)c3)[nH]c2c1
InChIInChI=1S/C14H9F4N3/c1-7-4-11-13(19-6-7)21-12(20-11)8-2-3-10(15)9(5-8)14(16,17)18/h2-6H,1H3,(H,19,20,21)
InChIKeyLBMFVUOYKCMCOV-UHFFFAOYSA-N
MW295.24 g/mol
LogP4.09
Rot. Bonds1

About 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine

2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 79791283) has the molecular formula C14H9F4N3 and a molecular weight of 295.24 g/mol. Its IUPAC name is 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID79791283
Molecular FormulaC14H9F4N3
Molecular Weight295.24 g/mol
Exact Mass295.07
IUPAC Name2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3ccc(F)c(C(F)(F)F)c3)[nH]c2c1
InChIInChI=1S/C14H9F4N3/c1-7-4-11-13(19-6-7)21-12(20-11)8-2-3-10(15)9(5-8)14(16,17)18/h2-6H,1H3,(H,19,20,21)
InChIKeyLBMFVUOYKCMCOV-UHFFFAOYSA-N
XLogP4.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.24
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
Glu-P 1
CID 49971
2-(pyridin-3-yl)-1H-1,3-benzodiazole
CID 247635
PF-4708671
CID 51371303
2-(Hydroxyamino)-1-methyl-6-phenylimidazo(4,5-b)pyridine
CID 104954
(alphaS)-7-Fluoro-alpha-methyl-N-9H-purin-6-yl-2-(2-pyridinyl)-3-quinolinemethanamine
CID 68947304
2-(3-Trifluoromethylphenyl)histamine
CID 5310982
2-(2'-Pyridyl)benzimidazole
CID 70821
2-(pyridin-4-yl)-1H-1,3-benzodiazole
CID 247634
Ralimetinib
CID 11539025
FR-79620
CID 10421577
Imidazo(4,5-b)pyridine
CID 67504

Frequently Asked Questions

What is the IUPAC name of 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine (CID 79791283) is 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(-c3ccc(F)c(C(F)(F)F)c3)[nH]c2c1.
What is the InChIKey of 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is LBMFVUOYKCMCOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F4N3/c1-7-4-11-13(19-6-7)21-12(20-11)8-2-3-10(15)9(5-8)14(16,17)18/h2-6H,1H3,(H,19,20,21).
What are the key properties of 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine?
2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 295.24 g/mol, XLogP of 4.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 79791283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).