1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate
TL;DR: 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate (CAS 1049976-46-6) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpiperidin-3-yl) (E)-3-(furan-2-yl)prop-2-enoate
Also Known As: 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate, (E)-1-methylpiperidin-3-yl 3-(furan-2-yl)acrylate, (1-methyl-3-piperidyl) (E)-3-(2-furyl)prop-2-enoate, (1-methylpiperidin-3-yl) (E)-3-(furan-2-yl)prop-2-enoate
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.9302 |
| Topological Polar Surface Area | 42.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 383.37866 |
Chemical Identifiers
| CAS Number | 1049976-46-6 |
|---|---|
| SMILES | CN1CCCC(C1)OC(=O)/C=C/C2=CC=CO2 |
Product Overview
1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate (CAS 1049976-46-6), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: (1-methylpiperidin-3-yl) (E)-3-(furan-2-yl)prop-2-enoate.
Chemical Property Profile of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate
Property Insights of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate
The XLogP value of 1.9302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate. With a topological polar surface area (TPSA) of 42.68 Ų, 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate has 0 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 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate?
The CAS number of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate is 1049976-46-6.
What is the molecular formula of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate?
The molecular formula of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate is C13H17NO3.
What is the molecular weight of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate?
The molecular weight of 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate is 235.12 g/mol.
Where can I buy 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate?
You can request a quote for 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate 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 (2E)-3-(furan-2-yl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 1-methylpiperidin-3-yl (2E)-3-(furan-2-yl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.