2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide

C14H9Br2F3N2 — CID 67122886

IUPAC2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide
SMILESBr.FC(F)(F)c1ccc2nc(-c3ccc(Br)cc3)cn2c1
InChIInChI=1S/C14H8BrF3N2.BrH/c15-11-4-1-9(2-5-11)12-8-20-7-10(14(16,17)18)3-6-13(20)19-12;/h1-8H;1H
InChIKeyPKNDROJZGNQGDJ-UHFFFAOYSA-N
MW422.04 g/mol
LogP5.36
Rot. Bonds1

About 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide

2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide (PubChem CID 67122886) has the molecular formula C14H9Br2F3N2 and a molecular weight of 422.04 g/mol. Its IUPAC name is 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide.

Molecular Properties

Compound Name2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide
PubChem CID67122886
Molecular FormulaC14H9Br2F3N2
Molecular Weight422.04 g/mol
Exact Mass419.91
IUPAC Name2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide
SMILESBr.FC(F)(F)c1ccc2nc(-c3ccc(Br)cc3)cn2c1
InChIInChI=1S/C14H8BrF3N2.BrH/c15-11-4-1-9(2-5-11)12-8-20-7-10(14(16,17)18)3-6-13(20)19-12;/h1-8H;1H
InChIKeyPKNDROJZGNQGDJ-UHFFFAOYSA-N
XLogP5.36
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.04
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide?
The IUPAC name of 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide (CID 67122886) is 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide.
What is the SMILES notation for 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide?
The canonical SMILES for 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide is Br.FC(F)(F)c1ccc2nc(-c3ccc(Br)cc3)cn2c1.
What is the InChIKey of 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide?
The InChIKey is PKNDROJZGNQGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrF3N2.BrH/c15-11-4-1-9(2-5-11)12-8-20-7-10(14(16,17)18)3-6-13(20)19-12;/h1-8H;1H.
What are the key properties of 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide?
2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide has a molecular weight of 422.04 g/mol, XLogP of 5.36, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine;hydrobromide is sourced from PubChem (CID 67122886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).