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1-[2-(2,4-Dibenzyloxyphenylacetyl)aminoethyl]piperidine

HCID 20071579
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Basic information

Standard SMILES
O=C(Cc1ccc(OCc2ccccc2)cc1OCc1ccccc1)NCCN1CCCCC1
InChIKey
BGARZVQVGQMEIN-UHFFFAOYSA-N
Molecular formula
C29H34N2O3
Average molar mass
458.6 g/mol

Names & identifiers

Preferred name
1-[2-(2,4-Dibenzyloxyphenylacetyl)aminoethyl]piperidine
IUPAC
2-[2,4-bis(phenylmethoxy)phenyl]-N-(2-piperidin-1-ylethyl)acetamide

Names & synonyms

SCHEMBL9785827BGARZVQVGQMEIN-UHFFFAOYSA-N1-[2-(2,4-dibenzyloxyphenylacetyl)aminoethyl]piperidine

Database identifiers

PubChem CID
20071579

Properties

Computed structural propertiesFilling in

XLogP
4.9
Topological polar surface area
50.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
34
Formal charge
0
Complexity
568

Related reactions

2 records
New reaction record
HRID 296116 reaction equation
HRID 296116As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 981413 reaction equation
HRID 981413As productuspto-grants-1991_02

Compound notes

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