![1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine structure](/static/products/880/880814-65-3.png)
1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine
TL;DR: 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine (CAS 880814-65-3) is a chemical compound with molecular formula C18H21NO2 and molecular weight 283.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)methanamine
Also Known As: AN-465/43369274, 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine, 1,3-benzodioxol-5-yl-N-(4-isopropylbenzyl)methanamine, Benzo[1,3]dioxol-5-ylmethyl-(4-isopropyl-benzyl)-amine, N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)methanamine
| Molecular Formula | C18H21NO2 |
|---|---|
| Molecular Weight | 283.16 g/mol |
| LogP | 3.8285 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.15723 |
| Heavy Atoms | 21 |
| Complexity | 605.1154 |
Chemical Identifiers
| CAS Number | 880814-65-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CNCC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine (CAS 880814-65-3), with molecular formula C18H21NO2 and molecular weight 283.16 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)methanamine.
Chemical Property Profile of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine
Property Insights of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine
The XLogP value of 3.8285 indicates that 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine 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 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine?
The CAS number of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine is 880814-65-3.
What is the molecular formula of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine?
The molecular formula of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine is C18H21NO2.
What is the molecular weight of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine?
The molecular weight of 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine is 283.16 g/mol.
Where can I buy 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine?
You can request a quote for 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)benzyl]methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.