CHEBI:93890 - 1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol

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ChEBI Name 1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol
ChEBI ID CHEBI:93890
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H36N2O2
Net Charge 0
Average Mass 336.513
Monoisotopic Mass 336.27768
InChI InChI=1S/C20H36N2O2/c1-21-3-5-22(6-4-21)14-19(23)15-24-7-2-20-11-16-8-17(12-20)10-18(9-16)13-20/h16-19,23H,2-15H2,1H3
InChIKey DNEUNQHNKDREAR-UHFFFAOYSA-N
SMILES CN1CCN(CC1)CC(COCCC23CC4CC(C2)CC(C4)C3)O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol (CHEBI:93890) is a N-methylpiperazine (CHEBI:46920)
Manual Xref Database
LSM-4465 LINCS
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