1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093)

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ChEBI Name	1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine

ChEBI ID	CHEBI:64093

Definition	An N-alkylpiperazine that consists of piperazine bearing 2-(benzhydryloxy)ethyl and 3-phenylpropyl groups at positions 1 and 4 respectively. Potent and selective inhibitor of dopamine uptake (K_D = 5.5 nM in rat striatal membranes).

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C28H34N2O

Net Charge

Average Mass

414.58240

Monoisotopic Mass

414.26711

InChI

InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2

InChIKey

RAQPOZGWANIDQT-UHFFFAOYSA-N

SMILES

C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	dopamine uptake inhibitor A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.

Application(s):	dopamine uptake inhibitor A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.

ChEBI Ontology
Outgoing	1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093) has role dopamine uptake inhibitor (CHEBI:51039) 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093) is a N-alkylpiperazine (CHEBI:46845) 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093) is a ether (CHEBI:25698) 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093) is a tertiary amino compound (CHEBI:50996) 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093) is conjugate base of 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+) (CHEBI:64092)

Incoming	1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+) (CHEBI:64092) is conjugate acid of 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine (CHEBI:64093)

IUPAC Name

1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine

Last Modified

25 February 2016