tert-butyl (3RS,4RS)-4-(4-bromophenyl)-3-(naphthalen-2-ylmethoxy)-piperidine-1-carboxylate

HCID 54500256
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(c2ccc(Br)cc2)C(OCc2ccc3ccccc3c2)C1
InChIKey
YBXMLIZYJHSGAX-UHFFFAOYSA-N
Molecular formula
C27H30BrNO3
Average molar mass
496.4 g/mol
Monoisotopic mass
495.14091

Names & identifiers

Preferred name
tert-butyl (3RS,4RS)-4-(4-bromophenyl)-3-(naphthalen-2-ylmethoxy)-piperidine-1-carboxylate
IUPAC
tert-butyl 4-(4-bromophenyl)-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylate

Names & synonyms

YBXMLIZYJHSGAX-UHFFFAOYSA-Ntert-butyl (3RS,4RS)-4-(4-bromophenyl)-3-(naphthalen-2-ylmethoxy)-piperidine-1-carboxylate

Database identifiers

PubChem CID
54500256

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
32

Related reactions

2 records
New reaction record

Compound notes

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