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4-(3-(3-methylpyridin-2-yloxy)benzylidene)-N-(pyridin-3-yl)piperidine-1-carboxamide

HCID 24964423
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cccnc1Oc1cccc(C=C2CCN(C(=O)Nc3cccnc3)CC2)c1
InChIKey
QGTIMDVOHJTNRL-UHFFFAOYSA-N
Molecular formula
C24H24N4O2
Average molar mass
400.5 g/mol

Names & identifiers

Preferred name
4-(3-(3-methylpyridin-2-yloxy)benzylidene)-N-(pyridin-3-yl)piperidine-1-carboxamide
IUPAC
4-[[3-[(3-methyl-2-pyridinyl)oxy]phenyl]methylidene]-N-pyridin-3-ylpiperidine-1-carboxamide

Names & synonyms

SCHEMBL1010524QGTIMDVOHJTNRL-UHFFFAOYSA-N4-(3-(3-methylpyridin-2-yloxy)benzylidene)-N-(pyridin-3-yl)piperidine-1-carboxamide

Database identifiers

PubChem CID
24964423

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
67.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Formal charge
0
Complexity
586

Related reactions

2 records
New reaction record
HRID 193236 reaction equation
HRID 193236As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1666400 reaction equation
HRID 1666400As productuspto-grants-2011_10

Compound notes

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