1-Cinnamylpiperazine

C13H18N2CAS 18903-01-0202.30 g/mol

Open in Covalent MOL file
NHN
AlkeneSecondary amineTertiary amine

Properties

Molecular formula
C13H18N2
Molar mass
202.30 g/mol
Exact mass
202.1470 Da
Melting point
95 °C
Boiling point
112–114 °C (at 0.098 Torr)
logP
1.60Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
18903-01-0
SMILES
C(=Cc1ccccc1)CN1CCNCC1
InChIKey
WGEIOMTZIIOUMA-UHFFFAOYSA-N
InChI
InChI=1S/C13H18N2/c1-2-5-13(6-3-1)7-4-10-15-11-8-14-9-12-15/h1-7,14H,8-12H2

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Names and synonyms

10 names
  • Piperazine, 1-(3-phenyl-2-propen-1-yl)-
  • Piperazine, 1-cinnamyl-
  • Piperazine, 1-(3-phenyl-2-propenyl)-
  • 1-(3-Phenyl-2-propen-1-yl)piperazine
  • N-Cinnamylpiperazine
  • N-(3-Phenyl-2-propenyl)piperazine
  • 1-(3-Phenylallyl)piperazine
  • 4-Cinnamylpiperazine
  • 1-(3-Phenyl-2-propenyl)piperazine
  • 4-(3-Phenylallyl)piperazine

Work with 1-Cinnamylpiperazine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

trans-1-Cinnamylpiperazine87179-40-6Defined stereoisomer

Similar compounds

Cinnarizine298-57-757 % similar Bucinnazine17719-89-051 % similar Flunarizine52468-60-749 % similar 1-Benzylpiperazine2759-17-348 % similar 1-Benzylpiperazine2759-28-648 % similar 1-(2-Phenylethyl)piperazine5321-49-348 % similar Flunarizine hydrochloride30484-77-646 % similar 4-Benzylpiperazine hydrochloride110475-31-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Rel-(3aR,6aS)-Octahydro-2-(phenylmethyl)pyrrolo[3,4-c]pyrrole172739-04-7 3-(Butylphenylamino)propanenitrile61852-40-2

Elsewhere

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