4-(3,4-Dimethylphenoxy)-1-carbobenzyloxy-3-piperidone

HCID 20548892
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(OC2CCN(C(=O)OCc3ccccc3)CC2=O)cc1C
InChIKey
SGCZUYHONRVDFS-UHFFFAOYSA-N
Molecular formula
C21H23NO4
Average molar mass
353.4 g/mol

Names & identifiers

Preferred name
4-(3,4-Dimethylphenoxy)-1-carbobenzyloxy-3-piperidone
IUPAC
benzyl 4-(3,4-dimethylphenoxy)-3-oxopiperidine-1-carboxylate

Names & synonyms

SCHEMBL11231728SGCZUYHONRVDFS-UHFFFAOYSA-N4-(3,4-dimethylphenoxy)-1-carbobenzyloxy-3-piperidone

Database identifiers

PubChem CID
20548892

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
26

Related reactions

4 records
New reaction record

Compound notes

Loading…