(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol

HCID 11301992

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC[C@@](O)(C#CCO)[C@@H]1c1ccccc1
InChIKey
BGHZPLJYKUEURG-QFBILLFUSA-N
Molecular formula
C19H25NO4
Average molar mass
331.4 g/mol
Monoisotopic mass
331.17835828

Names & identifiers

Preferred name
(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol
IUPAC
tert-butyl (2S,3R)-3-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-phenylpiperidine-1-carboxylate

Names & synonyms

SCHEMBL5784123BGHZPLJYKUEURG-QFBILLFUSA-N(2S, 3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn- 1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-butoxycarbonyl-3-(3-hydroxypropyn-1yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butyloxycarbonyl-3-(3-hydroxypropyn-1yl)-2-phenylpiperidin-3-ol

Database identifiers

PubChem CID
11301992
Nikkaji
J1.617.091G

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
70 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
24

Related reactions

35 records

Compound notes

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