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4-[3-(4-fluorophenoxy)benzylidene]-N-pyridin-3-ylpiperidine-1-carboxamide

HCID 24968688
NotesReactions
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Basic information

Standard SMILES
O=C(Nc1cccnc1)N1CCC(=Cc2cccc(Oc3ccc(F)cc3)c2)CC1
InChIKey
BCNXHUOZOBLVTD-UHFFFAOYSA-N
Molecular formula
C24H22FN3O2
Average molar mass
403.4 g/mol

Names & identifiers

Preferred name
4-[3-(4-fluorophenoxy)benzylidene]-N-pyridin-3-ylpiperidine-1-carboxamide
IUPAC
4-[[3-(4-fluorophenoxy)phenyl]methylidene]-N-pyridin-3-ylpiperidine-1-carboxamide

Names & synonyms

SCHEMBL1011233BCNXHUOZOBLVTD-UHFFFAOYSA-N4-[3-(4-fluorophenoxy)benzylidene]-N-pyridin-3-ylpiperidine-1-carboxamide

Database identifiers

PubChem CID
24968688

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
54.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Formal charge
0
Complexity
581

Related reactions

2 records
New reaction record
HRID 944617 reaction equation
HRID 944617As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1666354 reaction equation
HRID 1666354As productuspto-grants-2011_10

Compound notes

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