N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide
TL;DR: N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide (CAS 100951-55-1) is a chemical compound with molecular formula C15H21N3O and molecular weight 259.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[cyano(phenyl)methyl]-2-(diethylamino)propanamide
Also Known As: N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide, N-[cyano(phenyl)methyl]-2-(diethylamino)propanamide, Propanamide,N-(cyanophenylmethyl)-2-(diethylamino)-, Propionamide, N-(alpha-cyanobenzyl)-2-(diethylamino)-, 4-14-00-01341 (Beilstein Handbook Reference)
Technical Specifications
| Molecular Formula | C15H21N3O |
| Molecular Weight | 259.16846 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 56.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 259.16846 Da |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
| SMILES | CCN(CC)C(C)C(=O)NC(C#N)C1=CC=CC=C1 |
| InChIKey | PHJPBXDBGUPVDE-UHFFFAOYSA-N |
Chemical Property Profile of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide
Property Insights of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide. With a topological polar surface area (TPSA) of 56.1 Ų, N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide?
The CAS number of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide is 100951-55-1.
What is the molecular formula of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide?
The molecular formula of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide is C15H21N3O.
What is the molecular weight of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide?
The molecular weight of N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide is 259.16846 g/mol.
Where can I buy N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide?
You can request a quote for N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide?
Yes, CoreyChem provides custom synthesis services for N-(alpha-Cyanobenzyl)-2-(diethylamino)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.