1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine

C15H19F3N2 — CID 72503526

IUPAC1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine
SMILESCN1CCN(C)C(C=Cc2ccc(C(F)(F)F)cc2)C1
InChIInChI=1S/C15H19F3N2/c1-19-9-10-20(2)14(11-19)8-5-12-3-6-13(7-4-12)15(16,17)18/h3-8,14H,9-11H2,1-2H3
InChIKeyCCRBQTVQQPMOLE-UHFFFAOYSA-N
MW284.33 g/mol
LogP2.96
Rot. Bonds2

About 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine

1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine (PubChem CID 72503526) has the molecular formula C15H19F3N2 and a molecular weight of 284.33 g/mol. Its IUPAC name is 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine.

Molecular Properties

Compound Name1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine
PubChem CID72503526
Molecular FormulaC15H19F3N2
Molecular Weight284.33 g/mol
Exact Mass284.15
IUPAC Name1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine
SMILESCN1CCN(C)C(C=Cc2ccc(C(F)(F)F)cc2)C1
InChIInChI=1S/C15H19F3N2/c1-19-9-10-20(2)14(11-19)8-5-12-3-6-13(7-4-12)15(16,17)18/h3-8,14H,9-11H2,1-2H3
InChIKeyCCRBQTVQQPMOLE-UHFFFAOYSA-N
XLogP2.96
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(trifluoromethyl)-4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
CID 11758889
2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]oxirane
CID 59001960
1-(1,4-dimethylpiperazin-2-yl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 79663724
1-[(3R)-3-[2-[4-(trifluoromethyl)phenyl]ethenyl]pyrrolidin-1-yl]prop-2-en-1-one
CID 171093114
[4-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]piperazin-2-yl]methanamine
CID 80504637
1-[(E)-2-[(3R)-3-ethenylcyclopentyl]ethenyl]-4-(trifluoromethyl)benzene
CID 166936181
1-[4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]piperidin-1-yl]prop-2-en-1-one
CID 171093201
(3E)-1-methyl-3-[[4-(trifluoromethyl)phenyl]methylidene]piperidin-4-one
CID 110539824
1-[(E)-3,3-dimethylbut-1-enyl]-4-(trifluoromethyl)benzene
CID 22975197
1-[3-ethyl-4-[(Z)-2-[4-(trifluoromethyl)phenyl]ethenyl]pyrrolidin-1-yl]prop-2-en-1-one
CID 171092991
(4R)-4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolan-2-ol
CID 102486493
1-[(1R,2R)-2-[(E)-2-phenylethenyl]cyclopropyl]-4-(trifluoromethyl)benzene
CID 166071874

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine?
The IUPAC name of 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine (CID 72503526) is 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine.
What is the SMILES notation for 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine?
The canonical SMILES for 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine is CN1CCN(C)C(C=Cc2ccc(C(F)(F)F)cc2)C1.
What is the InChIKey of 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine?
The InChIKey is CCRBQTVQQPMOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2/c1-19-9-10-20(2)14(11-19)8-5-12-3-6-13(7-4-12)15(16,17)18/h3-8,14H,9-11H2,1-2H3.
What are the key properties of 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine?
1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine has a molecular weight of 284.33 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-[2-[4-(trifluoromethyl)phenyl]ethenyl]piperazine is sourced from PubChem (CID 72503526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).