3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine

C14H8BrF3N2 — CID 172515069

IUPAC3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1ccc(-c2nc(Br)n3ccccc23)cc1
InChIInChI=1S/C14H8BrF3N2/c15-13-19-12(11-3-1-2-8-20(11)13)9-4-6-10(7-5-9)14(16,17)18/h1-8H
InChIKeyGWVDMRRMYOMORN-UHFFFAOYSA-N
MW341.13 g/mol
LogP4.78
Rot. Bonds1

About 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine

3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine (PubChem CID 172515069) has the molecular formula C14H8BrF3N2 and a molecular weight of 341.13 g/mol. Its IUPAC name is 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine
PubChem CID172515069
Molecular FormulaC14H8BrF3N2
Molecular Weight341.13 g/mol
Exact Mass339.98
IUPAC Name3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1ccc(-c2nc(Br)n3ccccc23)cc1
InChIInChI=1S/C14H8BrF3N2/c15-13-19-12(11-3-1-2-8-20(11)13)9-4-6-10(7-5-9)14(16,17)18/h1-8H
InChIKeyGWVDMRRMYOMORN-UHFFFAOYSA-N
XLogP4.78
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.13
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-(trifluoromethyl)phenyl]triazolo[1,5-a]pyridine
CID 102315418
2-[4-(trifluoromethyl)phenyl]-3-[[2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]imidazo[1,2-a]pyridine
CID 132518642
3-[4-(trifluoromethyl)phenyl]-1-[[3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]diselanyl]imidazo[1,5-a]pyridine
CID 139262365
1-(4-methylphenyl)-3-[1-(4-methylphenyl)imidazo[1,5-a]pyridin-3-yl]imidazo[1,5-a]pyridine
CID 132965985
ethyl (E)-3-[1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-3-yl]prop-2-enoate
CID 172515091
tert-butyl N-[2-[1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-3-yl]ethyl]carbamate
CID 11742008
1-(4-chlorophenyl)-3-(2-fluorophenyl)imidazo[1,5-a]pyridine
CID 132581655
3-(2-fluorophenyl)-1-phenylimidazo[1,5-a]pyridine
CID 132581650
5,10-dibromo-2,3,7,8-tetrakis[4-(trifluoromethyl)phenyl]pyrazino[2,3-g]quinoxaline
CID 176528078
3-[3,5-bis(1-phenylimidazo[1,5-a]pyridin-3-yl)phenyl]-1-phenylimidazo[1,5-a]pyridine
CID 132506865
1,3-dimethylimidazo[1,5-a]pyridine;ethane;1-methyl-3-[4-(trifluoromethyl)phenyl]benzene
CID 145208022
2,3,6-triphenyl-4,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 102130644

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine?
The IUPAC name of 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine (CID 172515069) is 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine is FC(F)(F)c1ccc(-c2nc(Br)n3ccccc23)cc1.
What is the InChIKey of 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine?
The InChIKey is GWVDMRRMYOMORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrF3N2/c15-13-19-12(11-3-1-2-8-20(11)13)9-4-6-10(7-5-9)14(16,17)18/h1-8H.
What are the key properties of 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine?
3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine has a molecular weight of 341.13 g/mol, XLogP of 4.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 172515069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).