5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine

C11H21F3N2 — CID 64848330

IUPAC5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine
SMILESCCC1(C)CN(CC(F)(F)F)C(C)(C)CN1
InChIInChI=1S/C11H21F3N2/c1-5-10(4)7-16(8-11(12,13)14)9(2,3)6-15-10/h15H,5-8H2,1-4H3
InChIKeyUHEKJFBRBUCKIK-UHFFFAOYSA-N
MW238.30 g/mol
LogP2.40
Rot. Bonds2

About 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine

5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine (PubChem CID 64848330) has the molecular formula C11H21F3N2 and a molecular weight of 238.30 g/mol. Its IUPAC name is 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine.

Molecular Properties

Compound Name5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine
PubChem CID64848330
Molecular FormulaC11H21F3N2
Molecular Weight238.30 g/mol
Exact Mass238.17
IUPAC Name5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine
SMILESCCC1(C)CN(CC(F)(F)F)C(C)(C)CN1
InChIInChI=1S/C11H21F3N2/c1-5-10(4)7-16(8-11(12,13)14)9(2,3)6-15-10/h15H,5-8H2,1-4H3
InChIKeyUHEKJFBRBUCKIK-UHFFFAOYSA-N
XLogP2.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine
CID 64849845
5-ethyl-1-(2-ethylbutyl)-2,2,5-trimethylpiperazine
CID 82925415
5-ethyl-1,2,2,5-tetramethylpiperazine
CID 64848331
5-ethyl-1-[(4-ethylphenyl)methyl]-2,2,5-trimethylpiperazine
CID 64850036
5-ethyl-2,2,5-trimethyl-1-(3-methylsulfonylpropyl)piperazine
CID 64849852
5-ethyl-1-[(2-fluorophenyl)methyl]-2,2,5-trimethylpiperazine
CID 64848517
1-ethyl-2,2,5,5-tetramethylpiperazine
CID 64838947
1-[(3-chloro-4-fluorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 103041811
1-[(2-chloro-5-fluorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 102620699
2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
CID 81114433
3-ethyl-3-methyl-1-[2-(trifluoromethylsulfanyl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 116627505
1-[(2,3-dichlorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 107310506

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine?
The IUPAC name of 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine (CID 64848330) is 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine.
What is the SMILES notation for 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine?
The canonical SMILES for 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine is CCC1(C)CN(CC(F)(F)F)C(C)(C)CN1.
What is the InChIKey of 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine?
The InChIKey is UHEKJFBRBUCKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2/c1-5-10(4)7-16(8-11(12,13)14)9(2,3)6-15-10/h15H,5-8H2,1-4H3.
What are the key properties of 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine?
5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine has a molecular weight of 238.30 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine is sourced from PubChem (CID 64848330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).