4-[1-Amino-2-(4-fluorophenyl)-ethyl]-4-hydroxypiperidine-1-carboxylic acid benzyl ester

HCID 57458014
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Basic information

Standard SMILES
NC(Cc1ccc(F)cc1)C1(O)CCN(C(=O)OCc2ccccc2)CC1
InChIKey
HEQWWMBASSVXNB-UHFFFAOYSA-N
Molecular formula
C21H25FN2O3
Average molar mass
372.4 g/mol
Monoisotopic mass
372.18492083

Names & identifiers

Preferred name
4-[1-Amino-2-(4-fluorophenyl)-ethyl]-4-hydroxypiperidine-1-carboxylic acid benzyl ester
IUPAC
benzyl 4-[1-amino-2-(4-fluorophenyl)ethyl]-4-hydroxypiperidine-1-carboxylate

Names & synonyms

SCHEMBL2770527HEQWWMBASSVXNB-UHFFFAOYSA-N4-[1-Amino-2-(4-fluorophenyl)-ethyl]-4-hydroxypiperidine-1-carboxylic acid benzyl ester

Database identifiers

PubChem CID
57458014

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
75.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
27

Related reactions

6 records
New reaction record

Compound notes

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