(S)-tert-butyl 3-(2-amino-5-(trifluoromethyl)phenoxy)piperidine-1-carboxylate

HCID 58413142
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC[C@H](Oc2cc(C(F)(F)F)ccc2N)C1
InChIKey
KCXPMWBUHBHFQI-LBPRGKRZSA-N
Molecular formula
C17H23F3N2O3
Average molar mass
360.4 g/mol
Monoisotopic mass
360.16607709

Names & identifiers

Preferred name
(S)-tert-butyl 3-(2-amino-5-(trifluoromethyl)phenoxy)piperidine-1-carboxylate
IUPAC
tert-butyl (3S)-3-[2-amino-5-(trifluoromethyl)phenoxy]piperidine-1-carboxylate

Names & synonyms

(S)-tert-butyl 3-(2-amino-5-(trifluoromethyl)phenoxy)piperidine-1-carboxylateSCHEMBL2406418

Database identifiers

PubChem CID
58413142

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
64.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
25

Related reactions

1 records
New reaction record

Compound notes

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(S)-tert-butyl 3-(2-amino-5-(trifluoromethyl)phenoxy)piperidine-1-carboxylate (HCID 58413142)｜Huagongshe