Tert-butyl 3-[[3-(4-fluorophenyl)-3-hydroxyhex-5-enyl]amino]piperidine-1-carboxylate

HCID 66858013
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Basic information

Standard SMILES
C=CCC(O)(CCNC1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1
InChIKey
QRVHJKHZPHJGGG-UHFFFAOYSA-N
Molecular formula
C22H33FN2O3
Average molar mass
392.5 g/mol

Names & identifiers

Preferred name
Tert-butyl 3-[[3-(4-fluorophenyl)-3-hydroxyhex-5-enyl]amino]piperidine-1-carboxylate
IUPAC
tert-butyl 3-[[3-(4-fluorophenyl)-3-hydroxyhex-5-enyl]amino]piperidine-1-carboxylate

Names & synonyms

SCHEMBL959817

Database identifiers

PubChem CID
66858013

Properties

Computed structural properties

XLogP
4
Topological polar surface area
61.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
28

Related reactions

1 records
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Compound notes

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