2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride
TL;DR: 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride (CAS 471289-71-1) is a chemical compound with molecular formula C19H29ClN2O and molecular weight 336.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-4H-isoquinolin-1-yl)octanamide;hydrochloride
Also Known As: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)octanamide Hydrochloride, 2-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride
| Molecular Formula | C19H29ClN2O |
|---|---|
| Molecular Weight | 336.20 g/mol |
| LogP | 4.3041 |
| Topological Polar Surface Area | 55.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 336.19684 |
| Heavy Atoms | 23 |
| Complexity | 566.243 |
Chemical Identifiers
| CAS Number | 471289-71-1 |
|---|---|
| SMILES | CCCCCCC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)N.Cl |
Product Overview
2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride (CAS 471289-71-1), with molecular formula C19H29ClN2O and molecular weight 336.20 g/mol. IUPAC: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)octanamide;hydrochloride.
Chemical Property Profile of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride
Property Insights of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride
The XLogP value of 4.3041 indicates that 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.45 Ų, 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride has 1 hydrogen bond donor(s) and 2 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 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride?
The CAS number of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride is 471289-71-1.
What is the molecular formula of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride?
The molecular formula of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride is C19H29ClN2O.
What is the molecular weight of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride?
The molecular weight of 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride is 336.20 g/mol.
Where can I buy 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride?
You can request a quote for 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,3-Dimethyl-3,4-dihydroisoquinolin-1-yl)octanamide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.