N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
TL;DR: N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine (CAS 860792-66-1) is a chemical compound with molecular formula C16H24N2O and molecular weight 260.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
Also Known As: N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine, AN-465/42518697, N-(3-ethoxybenzyl)quinuclidin-3-amine dihydrochloride, N-(1-azabicyclo[2.2.2]oct-3-yl)-N-(3-ethoxybenzyl)amine, N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-8-amine
| Molecular Formula | C16H24N2O |
|---|---|
| Molecular Weight | 260.19 g/mol |
| LogP | 2.2691 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.18887 |
| Heavy Atoms | 19 |
| Complexity | 412.9649 |
Chemical Identifiers
| CAS Number | 860792-66-1 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)CNC2CN3CCC2CC3 |
Product Overview
N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine (CAS 860792-66-1), with molecular formula C16H24N2O and molecular weight 260.19 g/mol. IUPAC: N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine.
Chemical Property Profile of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
Property Insights of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
The XLogP value of 2.2691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine. With a topological polar surface area (TPSA) of 24.5 Ų, N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine 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 N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine?
The CAS number of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine is 860792-66-1.
What is the molecular formula of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine?
The molecular formula of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine is C16H24N2O.
What is the molecular weight of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine?
The molecular weight of N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine is 260.19 g/mol.
Where can I buy N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine?
You can request a quote for N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-ethoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.