Methyl 3-[4-({4-[(4-hydroxypiperidin-1-yl)methyl]benzyl}oxy)phenyl]propanoate

HCID 23159986
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Basic information

Standard SMILES
COC(=O)CCc1ccc(OCc2ccc(CN3CCC(O)CC3)cc2)cc1
InChIKey
HYBFEKGAYABHLO-UHFFFAOYSA-N
Molecular formula
C23H29NO4
Average molar mass
383.5 g/mol
Monoisotopic mass
383.20965841

Names & identifiers

Preferred name
Methyl 3-[4-({4-[(4-hydroxypiperidin-1-yl)methyl]benzyl}oxy)phenyl]propanoate
IUPAC
methyl 3-[4-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoate

Names & synonyms

SCHEMBL2824416HYBFEKGAYABHLO-UHFFFAOYSA-Nmethyl 3-[4-({4-[(4-hydroxypiperidin-1-yl)methyl]benzyl}oxy)phenyl]propanoate

Database identifiers

PubChem CID
23159986

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
28

Related reactions

3 records
New reaction record

Compound notes

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