CHEBI:95085 - (5-bromo-3-pyridinyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone

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ChEBI Name (5-bromo-3-pyridinyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone
ChEBI ID CHEBI:95085
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H20BrN3O
Net Charge 0
Average Mass 338.243
Monoisotopic Mass 337.07898
InChI InChI=1S/C15H20BrN3O/c16-13-9-12(10-17-11-13)15(20)19-7-3-14(4-8-19)18-5-1-2-6-18/h9-11,14H,1-8H2
InChIKey CQERVFFAOOUFEQ-UHFFFAOYSA-N
SMILES C1CCN(C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)Br
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing (5-bromo-3-pyridinyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone (CHEBI:95085) is a aromatic carboxylic acid (CHEBI:33859)
(5-bromo-3-pyridinyl)-[4-(1-pyrrolidinyl)-1-piperidinyl]methanone (CHEBI:95085) is a pyridinemonocarboxylic acid (CHEBI:26420)
Manual Xref Database
LSM-6337 LINCS
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