1-Methylpiperidin-3-yl acetate
TL;DR: 1-Methylpiperidin-3-yl acetate (CAS 6659-33-2) is a chemical compound with molecular formula C8H15NO2 and molecular weight 157.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpiperidin-3-yl) acetate
Also Known As: Aceclidine Impurity 1, 1-methylpiperidin-3-yl acetate, 3-acetoxy-N-methylpiperidine, [butyl(diethyl)stannyl] acetate, 3-Acetoxy-N-methylazacyclohexan
| Molecular Formula | C8H15NO2 |
|---|---|
| Molecular Weight | 157.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.11028 |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 6659-33-2 |
|---|---|
| SMILES | CC(=O)OC1CCCN(C1)C |
| InChIKey | CTVJTRDKSBQDGV-UHFFFAOYSA-N |
Product Overview
1-Methylpiperidin-3-yl acetate (CAS 6659-33-2), with molecular formula C8H15NO2 and molecular weight 157.11 g/mol. IUPAC: (1-methylpiperidin-3-yl) acetate.
Chemical Property Profile of 1-Methylpiperidin-3-yl acetate
Property Insights of 1-Methylpiperidin-3-yl acetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylpiperidin-3-yl acetate. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Methylpiperidin-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpiperidin-3-yl acetate has 0 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-Methylpiperidin-3-yl acetate?
The CAS number of 1-Methylpiperidin-3-yl acetate is 6659-33-2.
What is the molecular formula of 1-Methylpiperidin-3-yl acetate?
The molecular formula of 1-Methylpiperidin-3-yl acetate is C8H15NO2.
What is the molecular weight of 1-Methylpiperidin-3-yl acetate?
The molecular weight of 1-Methylpiperidin-3-yl acetate is 157.11 g/mol.
Where can I buy 1-Methylpiperidin-3-yl acetate?
You can request a quote for 1-Methylpiperidin-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylpiperidin-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylpiperidin-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.