6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine

C15H10BrF3N2 — CID 83169792

IUPAC6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
SMILESCc1cc(Br)cn2cc(-c3ccccc3C(F)(F)F)nc12
InChIInChI=1S/C15H10BrF3N2/c1-9-6-10(16)7-21-8-13(20-14(9)21)11-4-2-3-5-12(11)15(17,18)19/h2-8H,1H3
InChIKeyIPYJUYRHQOUXGT-UHFFFAOYSA-N
MW355.16 g/mol
LogP5.09
Rot. Bonds1

About 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine

6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine (PubChem CID 83169792) has the molecular formula C15H10BrF3N2 and a molecular weight of 355.16 g/mol. Its IUPAC name is 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
PubChem CID83169792
Molecular FormulaC15H10BrF3N2
Molecular Weight355.16 g/mol
Exact Mass354.00
IUPAC Name6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
SMILESCc1cc(Br)cn2cc(-c3ccccc3C(F)(F)F)nc12
InChIInChI=1S/C15H10BrF3N2/c1-9-6-10(16)7-21-8-13(20-14(9)21)11-4-2-3-5-12(11)15(17,18)19/h2-8H,1H3
InChIKeyIPYJUYRHQOUXGT-UHFFFAOYSA-N
XLogP5.09
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.16
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine (CID 83169792) is 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine is Cc1cc(Br)cn2cc(-c3ccccc3C(F)(F)F)nc12.
What is the InChIKey of 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The InChIKey is IPYJUYRHQOUXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrF3N2/c1-9-6-10(16)7-21-8-13(20-14(9)21)11-4-2-3-5-12(11)15(17,18)19/h2-8H,1H3.
What are the key properties of 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine has a molecular weight of 355.16 g/mol, XLogP of 5.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 83169792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).