CHEBI:93702 - 1-[4-[4-[(3-methylphenyl)methylamino]phenyl]-1-piperazinyl]ethanone

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ChEBI Name 1-[4-[4-[(3-methylphenyl)methylamino]phenyl]-1-piperazinyl]ethanone
ChEBI ID CHEBI:93702
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H25N3O
Net Charge 0
Average Mass 323.433
Monoisotopic Mass 323.19976
InChI InChI=1S/C20H25N3O/c1-16-4-3-5-18(14-16)15-21-19-6-8-20(9-7-19)23-12-10-22(11-13-23)17(2)24/h3-9,14,21H,10-13,15H2,1-2H3
InChIKey FHJRAJAFJSVQFJ-UHFFFAOYSA-N
SMILES CC1=CC(=CC=C1)CNC2=CC=C(C=C2)N3CCN(CC3)C(=O)C
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-[4-[4-[(3-methylphenyl)methylamino]phenyl]-1-piperazinyl]ethanone (CHEBI:93702) is a aromatic amine (CHEBI:33860)
Manual Xref Database
LSM-4186 LINCS
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