2-(2,2,2-trifluoroethyl)piperazine

C6H11F3N2 — CID 54215917

IUPAC2-(2,2,2-trifluoroethyl)piperazine
SMILESFC(F)(F)CC1CNCCN1
InChIInChI=1S/C6H11F3N2/c7-6(8,9)3-5-4-10-1-2-11-5/h5,10-11H,1-4H2
InChIKeyFAXXAILEMUPCBP-UHFFFAOYSA-N
MW168.16 g/mol
LogP0.50
Rot. Bonds1

About 2-(2,2,2-trifluoroethyl)piperazine

2-(2,2,2-trifluoroethyl)piperazine (PubChem CID 54215917) has the molecular formula C6H11F3N2 and a molecular weight of 168.16 g/mol. Its IUPAC name is 2-(2,2,2-trifluoroethyl)piperazine.

Molecular Properties

Compound Name2-(2,2,2-trifluoroethyl)piperazine
PubChem CID54215917
Molecular FormulaC6H11F3N2
Molecular Weight168.16 g/mol
Exact Mass168.09
IUPAC Name2-(2,2,2-trifluoroethyl)piperazine
SMILESFC(F)(F)CC1CNCCN1
InChIInChI=1S/C6H11F3N2/c7-6(8,9)3-5-4-10-1-2-11-5/h5,10-11H,1-4H2
InChIKeyFAXXAILEMUPCBP-UHFFFAOYSA-N
XLogP0.50
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2,2-trifluoroethyl)piperazine?
The IUPAC name of 2-(2,2,2-trifluoroethyl)piperazine (CID 54215917) is 2-(2,2,2-trifluoroethyl)piperazine.
What is the SMILES notation for 2-(2,2,2-trifluoroethyl)piperazine?
The canonical SMILES for 2-(2,2,2-trifluoroethyl)piperazine is FC(F)(F)CC1CNCCN1.
What is the InChIKey of 2-(2,2,2-trifluoroethyl)piperazine?
The InChIKey is FAXXAILEMUPCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2/c7-6(8,9)3-5-4-10-1-2-11-5/h5,10-11H,1-4H2.
What are the key properties of 2-(2,2,2-trifluoroethyl)piperazine?
2-(2,2,2-trifluoroethyl)piperazine has a molecular weight of 168.16 g/mol, XLogP of 0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,2-trifluoroethyl)piperazine is sourced from PubChem (CID 54215917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).