N-(2-(3,3-Diphenyl-1-propyloxy)ethyl)-1,2,5,6-tetrahydro-3-pyridinecarboxylic acid ethyl ester

HCID 10691978
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C1=CCCN(CCOCCC(c2ccccc2)c2ccccc2)C1
InChIKey
JLRAPYPRELJYSW-UHFFFAOYSA-N
Molecular formula
C25H31NO3
Average molar mass
393.5 g/mol

Names & identifiers

Preferred name
N-(2-(3,3-Diphenyl-1-propyloxy)ethyl)-1,2,5,6-tetrahydro-3-pyridinecarboxylic acid ethyl ester
IUPAC
ethyl 1-[2-(3,3-diphenylpropoxy)ethyl]-3,6-dihydro-2H-pyridine-5-carboxylate

Names & synonyms

SCHEMBL7928811JLRAPYPRELJYSW-UHFFFAOYSA-NN-(2-(3,3-Diphenyl-1-propyloxy)ethyl)-1,2,5,6-tetrahydro-3-pyridinecarboxylic acid ethyl ester

Database identifiers

PubChem CID
10691978

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
29

Related reactions

3 records
New reaction record

Compound notes

Loading…