2-((2S)-2-Amino-1-hydroxy-3-phenylpropyl)-6-ethylpiperidine-1-carboxylic acid tert-butyl ester

HCID 69014475
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Basic information

Standard SMILES
CCC1CCCC(C(O)[C@@H](N)Cc2ccccc2)N1C(=O)OC(C)(C)C
InChIKey
BNJDNGWHYOYHQA-JRVPFXOQSA-N
Molecular formula
C21H34N2O3
Average molar mass
362.5 g/mol
Monoisotopic mass
362.25694295

Names & identifiers

Preferred name
2-((2S)-2-Amino-1-hydroxy-3-phenylpropyl)-6-ethylpiperidine-1-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 2-[(2S)-2-amino-1-hydroxy-3-phenylpropyl]-6-ethylpiperidine-1-carboxylate

Names & synonyms

SCHEMBL4356137BNJDNGWHYOYHQA-JRVPFXOQSA-N2-((2S)-2-Amino-1-hydroxy-3-phenylpropyl)-6-ethylpiperidine-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
69014475

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
75.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
26

Related reactions

1 records
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Compound notes

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