N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine
TL;DR: N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine (CAS 892580-06-2) is a chemical compound with molecular formula C18H22FNO and molecular weight 287.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-methylpropan-2-amine
Also Known As: N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine, AN-465/42966083, N-(1,1-Dimethylethyl)-3-[(4-fluorophenyl)methoxy]benzenemethanamine, N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-methylpropan-2-amine, N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-methyl-propan-2-amine
| Molecular Formula | C18H22FNO |
|---|---|
| Molecular Weight | 287.17 g/mol |
| LogP | 4.2928 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.16855 |
| Heavy Atoms | 21 |
| Complexity | 572.51733 |
Chemical Identifiers
| CAS Number | 892580-06-2 |
|---|---|
| SMILES | CC(C)(C)NCC1=CC(=CC=C1)OCC2=CC=C(C=C2)F |
Product Overview
N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine (CAS 892580-06-2), with molecular formula C18H22FNO and molecular weight 287.17 g/mol. IUPAC: N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-methylpropan-2-amine.
Chemical Property Profile of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine
Property Insights of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine
The XLogP value of 4.2928 indicates that N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine 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 N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine?
The CAS number of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine is 892580-06-2.
What is the molecular formula of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine?
The molecular formula of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine is C18H22FNO.
What is the molecular weight of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine?
The molecular weight of N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine is 287.17 g/mol.
Where can I buy N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine?
You can request a quote for N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-butyl)-N-{3-[(4-fluorobenzyl)oxy]benzyl}amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.