![Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate structure](/static/products/675/675841-80-2.png)
Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate
TL;DR: Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate (CAS 675841-80-2) is a chemical compound with molecular formula C21H31NO3 and molecular weight 345.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(E)-3-(1-adamantyl)-3-oxoprop-1-enyl]piperidine-4-carboxylate
Also Known As: ethyl 1-[(E)-3-(1-adamantyl)-3-oxoprop-1-enyl]piperidine-4-carboxylate, (E)-ethyl 1-(3-(adamantan-1-yl)-3-oxoprop-1-en-1-yl)piperidine-4-carboxylate, ETHYL 1-[(E)-3-(1-ADAMANTYL)-3-OXO-1-PROPENYL]-4-PIPERIDINECARBOXYLATE, ethyl 1-[(1E)-3-oxo-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)prop-1-en-1-yl]piperidine-4-carboxylate
| Molecular Formula | C21H31NO3 |
|---|---|
| Molecular Weight | 345.23 g/mol |
| LogP | 3.5607 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.2304 |
| Heavy Atoms | 25 |
| Complexity | 524.2043 |
Chemical Identifiers
| CAS Number | 675841-80-2 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)/C=C/C(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate (CAS 675841-80-2), with molecular formula C21H31NO3 and molecular weight 345.23 g/mol. IUPAC: ethyl 1-[(E)-3-(1-adamantyl)-3-oxoprop-1-enyl]piperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate
Property Insights of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate
The XLogP value of 3.5607 indicates that Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate 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 Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate?
The CAS number of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate is 675841-80-2.
What is the molecular formula of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate?
The molecular formula of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate is C21H31NO3.
What is the molecular weight of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate?
The molecular weight of Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate is 345.23 g/mol.
Where can I buy Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate?
You can request a quote for Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(E)-3-(1-adamantyl)-3-oxo-1-propenyl]-4-piperidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.