1,5,5-trimethyl-2-(trifluoromethyl)piperazine

C8H15F3N2 — CID 84666814

IUPAC1,5,5-trimethyl-2-(trifluoromethyl)piperazine
SMILESCN1CC(C)(C)NCC1C(F)(F)F
InChIInChI=1S/C8H15F3N2/c1-7(2)5-13(3)6(4-12-7)8(9,10)11/h6,12H,4-5H2,1-3H3
InChIKeyBFVIMBUPLCTCEH-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.23
Rot. Bonds

About 1,5,5-trimethyl-2-(trifluoromethyl)piperazine

1,5,5-trimethyl-2-(trifluoromethyl)piperazine (PubChem CID 84666814) has the molecular formula C8H15F3N2 and a molecular weight of 196.22 g/mol. Its IUPAC name is 1,5,5-trimethyl-2-(trifluoromethyl)piperazine.

Molecular Properties

Compound Name1,5,5-trimethyl-2-(trifluoromethyl)piperazine
PubChem CID84666814
Molecular FormulaC8H15F3N2
Molecular Weight196.22 g/mol
Exact Mass196.12
IUPAC Name1,5,5-trimethyl-2-(trifluoromethyl)piperazine
SMILESCN1CC(C)(C)NCC1C(F)(F)F
InChIInChI=1S/C8H15F3N2/c1-7(2)5-13(3)6(4-12-7)8(9,10)11/h6,12H,4-5H2,1-3H3
InChIKeyBFVIMBUPLCTCEH-UHFFFAOYSA-N
XLogP1.23
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,5,5-trimethyl-2-(trifluoromethyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,5-dimethyl-1-propan-2-yl-2-(trifluoromethyl)piperazine
CID 84689190
(2S)-1,5,5-trimethyl-2-propan-2-ylpiperazine
CID 94982663
2,5,5-trimethyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]piperazine
CID 64840444
5,5-dimethyl-1-(trifluoromethyl)piperazine-2-carbaldehyde
CID 174576382
2-tert-butyl-1-cycloheptyl-5,5-dimethylpiperazine
CID 82936936
2-tert-butyl-1-(3-ethylsulfonylpropyl)-5,5-dimethylpiperazine
CID 65097540
5,5-dimethyl-2-propyl-1-[2-(trifluoromethylsulfanyl)ethyl]piperazine
CID 116627433
2-tert-butyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64840094
4,4-difluoro-2-(2-fluoropropan-2-yl)-1-methylpyrrolidine
CID 176557306
1-benzyl-2-tert-butyl-5,5-dimethylpiperazine
CID 64839732
1-(3-ethylpentan-3-yl)-2,5,5-trimethylpiperazine
CID 65043445
2-tert-butyl-1-[(2,5-difluorophenyl)methyl]-5,5-dimethylpiperazine
CID 64839540

Frequently Asked Questions

What is the IUPAC name of 1,5,5-trimethyl-2-(trifluoromethyl)piperazine?
The IUPAC name of 1,5,5-trimethyl-2-(trifluoromethyl)piperazine (CID 84666814) is 1,5,5-trimethyl-2-(trifluoromethyl)piperazine.
What is the SMILES notation for 1,5,5-trimethyl-2-(trifluoromethyl)piperazine?
The canonical SMILES for 1,5,5-trimethyl-2-(trifluoromethyl)piperazine is CN1CC(C)(C)NCC1C(F)(F)F.
What is the InChIKey of 1,5,5-trimethyl-2-(trifluoromethyl)piperazine?
The InChIKey is BFVIMBUPLCTCEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2/c1-7(2)5-13(3)6(4-12-7)8(9,10)11/h6,12H,4-5H2,1-3H3.
What are the key properties of 1,5,5-trimethyl-2-(trifluoromethyl)piperazine?
1,5,5-trimethyl-2-(trifluoromethyl)piperazine has a molecular weight of 196.22 g/mol, XLogP of 1.23, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5-trimethyl-2-(trifluoromethyl)piperazine is sourced from PubChem (CID 84666814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).