Basic information
- Standard SMILES
CCOC(=O)CCCCN(CCc1ccccc1OC)C1CCCc2nc(C#N)ccc21- InChIKey
IPKJRVURWPEGQS-UHFFFAOYSA-N- Molecular formula
- C26H33N3O3
- Average molar mass
- 435.6 g/mol
Names & identifiers
- Preferred name
- Ethyl 5-{(2-cyano-5,6,7,8-tetrahydroquinolin-5-yl)[2-(2-methoxyphenyl)ethyl]amino}pentanoate
- IUPAC
- ethyl 5-[(2-cyano-5,6,7,8-tetrahydroquinolin-5-yl)-[2-(2-methoxyphenyl)ethyl]amino]pentanoate
Names & synonyms
SCHEMBL15437326IPKJRVURWPEGQS-UHFFFAOYSA-Nethyl 5-{(2-cyano-5,6,7,8-tetrahydroquinolin-5-yl)[2-(2-methoxyphenyl)ethyl]amino}pentanoaterac-Ethyl 5-{(2-cyano-5,6,7,8-tetrahydroquinolin-5-yl) [2-(2-methoxyphenyl)ethyl]amino}-pentanoaterac-Ethyl 5-{(2-cyano-5,6,7,8-tetrahydroquinolin-5-yl)[2-(2-methoxyphenyl)ethyl]amino}-pentanoate
Database identifiers
- PubChem CID
- 89940888
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 75.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 619
Related reactions
2 records
Compound notes
Loading…