chempirical

1-[3-(Trifluoromethyl)phenyl]piperazine

C11H13F3N2CAS 15532-75-9230.23 g/mol

Open in Covalent MOL file
FFFNNH
Alkyl halideSecondary amineTertiary amine

Properties

Molecular formula
C11H13F3N2
Molar mass
230.23 g/mol
Exact mass
230.1031 Da
logP
2.12Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
15532-75-9
SMILES
FC(F)(F)c1cccc(N2CCNCC2)c1
InChIKey
KKIMDKMETPPURN-UHFFFAOYSA-N
InChI
InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2

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Names and synonyms

14 names · show all
  • Piperazine, 1-[3-(trifluoromethyl)phenyl]-
  • N-(3-Trifluoromethylphenyl)piperazine
  • N-(m-Trifluoromethylphenyl)piperazine
  • m-Trifluoromethylphenylpiperazine
  • 4-[3-(Trifluoromethyl)phenyl]piperazine
  • TFMPP
  • 1-(α,α,α-Trifluoro-m-tolyl)piperazine
  • NSC 128882
  • Trifluoromethylphenylpiperazine
  • 1-(3-(Trifluromethyl)phenyl)piperazine
  • CD 3-3015
  • Piperazine, 1-(α,α,α-trifluoro-m-tolyl)-
  • 1-[m-(Trifluoromethyl)phenyl]piperazine
  • N-(α,α,α-Trifluoro-m-tolyl)piperazine

Work with 1-[3-(Trifluoromethyl)phenyl]piperazine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(3-Trifluoromethylphenyl)piperazine hydrochloride16015-69-391 % similar 1-(3-Fluorophenyl)piperazine3801-89-660 % similar 1-[4-Chloro-3-(trifluoromethyl)phenyl]piperazine41213-04-159 % similar 1-(3-Chlorophenyl)piperazine6640-24-057 % similar 1-(3-Biphenylyl)piperazine115761-61-054 % similar 1-(3-Bromophenyl)piperazine31197-30-554 % similar 1-(3-Methylphenyl)piperazine41186-03-254 % similar 3-(Trifluoromethyl)benzyl chloride705-29-353 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-(Pyrrolidin-1-yl)-5-(trifluoromethyl)aniline133184-80-2 1-[4-(Trifluoromethyl)phenyl]piperazine30459-17-7 1-[2-(Trifluoromethyl)phenyl]piperazine63854-31-9

Elsewhere

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