![N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine structure](/static/products/401/401501-91-5.png)
N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine
TL;DR: N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine (CAS 401501-91-5) is a chemical compound with molecular formula C16H25NO and molecular weight 247.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-tert-butylphenoxy)-N-prop-2-enylpropan-1-amine
Also Known As: N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine, 3-(2-tert-butylphenoxy)-N-prop-2-enylpropan-1-amine
| Molecular Formula | C16H25NO |
|---|---|
| Molecular Weight | 247.19 g/mol |
| LogP | 3.5286 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 247.19362 |
| Heavy Atoms | 18 |
| Complexity | 365.60486 |
Chemical Identifiers
| CAS Number | 401501-91-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=CC=C1OCCCNCC=C |
Product Overview
N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine (CAS 401501-91-5), with molecular formula C16H25NO and molecular weight 247.19 g/mol. IUPAC: 3-(2-tert-butylphenoxy)-N-prop-2-enylpropan-1-amine.
Chemical Property Profile of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine
Property Insights of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine
The XLogP value of 3.5286 indicates that N-allyl-N-[3-(2-tert-butylphenoxy)propyl]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-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-N-[3-(2-tert-butylphenoxy)propyl]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-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine?
The CAS number of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine is 401501-91-5.
What is the molecular formula of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine?
The molecular formula of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine is C16H25NO.
What is the molecular weight of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine?
The molecular weight of N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine is 247.19 g/mol.
Where can I buy N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine?
You can request a quote for N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-N-[3-(2-tert-butylphenoxy)propyl]amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.