5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine

C15H19F3N2 — CID 64932560

IUPAC5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine
SMILESCC1CNC(C2CC2)CN1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2/c1-10-8-19-14(11-2-3-11)9-20(10)13-6-4-12(5-7-13)15(16,17)18/h4-7,10-11,14,19H,2-3,8-9H2,1H3
InChIKeyWWEWPUMWTJIXQR-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.28
Rot. Bonds2

About 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine

5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine (PubChem CID 64932560) has the molecular formula C15H19F3N2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine
PubChem CID64932560
Molecular FormulaC15H19F3N2
Molecular Weight284.32 g/mol
Exact Mass284.15
IUPAC Name5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine
SMILESCC1CNC(C2CC2)CN1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2/c1-10-8-19-14(11-2-3-11)9-20(10)13-6-4-12(5-7-13)15(16,17)18/h4-7,10-11,14,19H,2-3,8-9H2,1H3
InChIKeyWWEWPUMWTJIXQR-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2,5-dimethyl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 70804072
2,5-dimethyl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 11565121
1-(4-chlorophenyl)-5-cyclopropyl-2-methylpiperazine
CID 64933898
5-cyclopropyl-2-methyl-1-(4-propoxyphenyl)piperazine
CID 64946803
1-(4-bromo-3-methoxyphenyl)-5-cyclopropyl-2-methylpiperazine
CID 82861136
2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine;hydrochloride
CID 69041767
5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine
CID 107603836
5-cyclopropyl-1-(2,4-dimethylphenyl)-2-methylpiperazine
CID 64930667
5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine
CID 64930554
1-(2-bromo-5-methylphenyl)-5-cyclopropyl-2-methylpiperazine
CID 82758492
1-(4-bromo-2,5-difluorophenyl)-5-cyclopropyl-2-methylpiperazine
CID 107608147
5-cyclopropyl-1-(2,5-dimethoxyphenyl)-2-methylpiperazine
CID 64932759

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine?
The IUPAC name of 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine (CID 64932560) is 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine is CC1CNC(C2CC2)CN1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine?
The InChIKey is WWEWPUMWTJIXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2/c1-10-8-19-14(11-2-3-11)9-20(10)13-6-4-12(5-7-13)15(16,17)18/h4-7,10-11,14,19H,2-3,8-9H2,1H3.
What are the key properties of 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine?
5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine has a molecular weight of 284.32 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine is sourced from PubChem (CID 64932560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).