Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-
TL;DR: Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- (CAS 100951-58-4) is a chemical compound with molecular formula C15H21N3O and molecular weight 259.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[cyano(phenyl)methyl]-2-(dimethylamino)pentanamide
Also Known As: N-(alpha-Cyanobenzyl)-2-(dimethylamino)valeramide, 4-14-00-01342 (Beilstein Handbook Reference), Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-, N-[cyano(phenyl)methyl]-2-(dimethylamino)pentanamide, N-[Cyano(phenyl)methyl]-2-(dimethylamino)pentanimidic acid
| Molecular Formula | C15H21N3O |
|---|---|
| Molecular Weight | 259.17 g/mol |
| LogP | 2.09778 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 259.16846 |
| Heavy Atoms | 19 |
| Complexity | 436.45395 |
Chemical Identifiers
| CAS Number | 100951-58-4 |
|---|---|
| SMILES | CCCC(C(=O)NC(C#N)C1=CC=CC=C1)N(C)C |
Product Overview
Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- (CAS 100951-58-4), with molecular formula C15H21N3O and molecular weight 259.17 g/mol. IUPAC: N-[cyano(phenyl)methyl]-2-(dimethylamino)pentanamide.
Chemical Property Profile of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-
Property Insights of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-
The XLogP value of 2.09778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-. With a topological polar surface area (TPSA) of 56.13 Ų, Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- 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
Frequently Asked Questions
What is the CAS number of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-?
The CAS number of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- is 100951-58-4.
What is the molecular formula of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-?
The molecular formula of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- is C15H21N3O.
What is the molecular weight of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-?
The molecular weight of Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- is 259.17 g/mol.
Where can I buy Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-?
You can request a quote for Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Valeramide, N-(alpha-cyanobenzyl)-2-(dimethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.