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Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine
TL;DR: Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine (CAS 416865-72-0) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 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-methylpiperidin-4-amine
Also Known As: Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine, 2973AE, N-(Benzo[d][1,3]dioxol-5-ylmethyl)-1-methylpiperidin-4-amine, BAS 05372534, N-(1,3-benzodioxol-5-ylmethyl)-1-methylpiperidin-4-amine
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 416865-72-0 |
|---|---|
| SMILES | CN1CCC(CC1)NCC2=CC3=C(C=C2)OCO3 |
| InChIKey | PMZJBCZZCJVNPS-UHFFFAOYSA-N |
Product Overview
Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine (CAS 416865-72-0), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-1-methylpiperidin-4-amine.
Chemical Property Profile of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine
Property Insights of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine. With a topological polar surface area (TPSA) of 33.7 Ų, Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine has 1 hydrogen bond donor(s) and 4 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 Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine?
The CAS number of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine is 416865-72-0.
What is the molecular formula of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine?
The molecular formula of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine is C14H20N2O2.
What is the molecular weight of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine?
The molecular weight of Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine is 248.15 g/mol.
Where can I buy Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine?
You can request a quote for Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine?
Yes, KEHONG BIO provides custom synthesis services for Benzo[1,3]dioxol-5-ylmethyl-(1-methyl-piperidin-4-yl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.