2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine

C20H14F3N3 — CID 10043630

IUPAC2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine
SMILESFC(F)(F)c1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1
InChIInChI=1S/C20H14F3N3/c21-20(22,23)16-8-6-14(7-9-16)12-26-11-10-17-18(13-26)25-19(24-17)15-4-2-1-3-5-15/h1-11,13H,12H2
InChIKeyWRXLFFYLXHPHFE-UHFFFAOYSA-N
MW353.35 g/mol
LogP5.12
Rot. Bonds3

About 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine

2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine (PubChem CID 10043630) has the molecular formula C20H14F3N3 and a molecular weight of 353.35 g/mol. Its IUPAC name is 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine
PubChem CID10043630
Molecular FormulaC20H14F3N3
Molecular Weight353.35 g/mol
Exact Mass353.11
IUPAC Name2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine
SMILESFC(F)(F)c1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1
InChIInChI=1S/C20H14F3N3/c21-20(22,23)16-8-6-14(7-9-16)12-26-11-10-17-18(13-26)25-19(24-17)15-4-2-1-3-5-15/h1-11,13H,12H2
InChIKeyWRXLFFYLXHPHFE-UHFFFAOYSA-N
XLogP5.12
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.35
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine?
The IUPAC name of 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine (CID 10043630) is 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine?
The canonical SMILES for 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine is FC(F)(F)c1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1.
What is the InChIKey of 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine?
The InChIKey is WRXLFFYLXHPHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3N3/c21-20(22,23)16-8-6-14(7-9-16)12-26-11-10-17-18(13-26)25-19(24-17)15-4-2-1-3-5-15/h1-11,13H,12H2.
What are the key properties of 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine?
2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine has a molecular weight of 353.35 g/mol, XLogP of 5.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine is sourced from PubChem (CID 10043630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).