structure of 1-(2-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine

1-(2-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine

CAS No.: 1000339-99-0
M. Wt: 275.27000
M. Fa: C12H16F3N3O
InChI Key: ZVFRHRVMTKRPPX-UHFFFAOYSA-N

Names and Identifiers of 1000339-99-0

CAS Number

1000339-99-0

MDL Number

MFCD09836181

IUPAC Name

1-[2-[5-(trifluoromethyl)pyridin-2-yl]oxyethyl]piperazine

InChI

InChI=1S/C12H16F3N3O/c13-12(14,15)10-1-2-11(17-9-10)19-8-7-18-5-3-16-4-6-18/h1-2,9,16H,3-8H2

InChIKey

ZVFRHRVMTKRPPX-UHFFFAOYSA-N

Canonical SMILES

FC(F)(F)C1=CC=C(OCCN2CCNCC2)N=C1

UNSPSC Code

12352100

Physical and chemical properties of 1000339-99-0

Acidity coefficient

9.09±0.10(Predicted)

Boiling Point

355.2±42.0 °C(Predicted)

Density

1.216±0.06 g/cm3(Predicted)

Exact Mass

275.12500

LogP

1.65110

Molecular Formula

C12H16F3N3O

Molecular Weight

275.27000

PSA

37.39000

Safety Information of 1000339-99-0

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000339-99-0

1-(2-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine has potential applications in medicinal chemistry, particularly in drug development targeting various diseases due to its unique structural features. Its ability to modulate biological pathways makes it a candidate for therapeutic agents in treating conditions such as cancer and neurological disorders.

Interaction Studies of 1000339-99-0

Research on 1-(2-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine's interaction with biological targets is ongoing. Preliminary studies suggest that it may interact with specific receptors and enzymes involved in critical signaling pathways. Understanding these interactions can provide insights into its mechanism of action and potential therapeutic uses.

Biological Activity of 1000339-99-0

The biological activity of 1-(2-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine is linked to its interaction with various molecular targets. It may modulate the activity of specific enzymes and receptors, potentially influencing signaling pathways related to inflammation, cell proliferation, and apoptosis. The trifluoromethyl group is known to enhance metabolic stability, making this compound a candidate for further pharmacological studies.