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6-Bromo-4-[4-(2-pyridyloxy)piperidino]quinoline

HCID 22032069
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Brc1ccc2nccc(N3CCC(Oc4ccccn4)CC3)c2c1
InChIKey
PEOHZPCGIONZPT-UHFFFAOYSA-N
Molecular formula
C19H18BrN3O
Average molar mass
384.3 g/mol

Names & identifiers

Preferred name
6-Bromo-4-[4-(2-pyridyloxy)piperidino]quinoline
IUPAC
6-bromo-4-(4-pyridin-2-yloxypiperidin-1-yl)quinoline

Names & synonyms

SCHEMBL3852745PEOHZPCGIONZPT-UHFFFAOYSA-N6-Bromo-4-[4-(2-pyridyloxy)piperidino]quinoline

Database identifiers

PubChem CID
22032069

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
38.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
402

Related reactions

2 records
New reaction record
HRID 113159 reaction equation
HRID 113159As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1792440 reaction equation
HRID 1792440As productuspto-grants-2006_07

Compound notes

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