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Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate
TL;DR: Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate (CAS 1024487-04-4) is a chemical compound with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate
Also Known As: Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate, ethyl 1-{[(4-cyanophenyl)amino]carbonyl}piperidine-4-carboxylate, ethyl 1-((4-cyanophenyl)carbamoyl)piperidine-4-carboxylate, Ethyl1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate, ethyl 1-([(4-cyanophenyl)amino]carbonyl)piperidine-4-carboxylate
| Molecular Formula | C16H19N3O3 |
|---|---|
| Molecular Weight | 301.14 g/mol |
| LogP | 2.36528 |
| Topological Polar Surface Area | 82.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.14264 |
| Heavy Atoms | 22 |
| Complexity | 569.294 |
Chemical Identifiers
| CAS Number | 1024487-04-4 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C(=O)NC2=CC=C(C=C2)C#N |
Product Overview
Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate (CAS 1024487-04-4), with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol. IUPAC: ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate
Property Insights of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate
The XLogP value of 2.36528 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate. The TPSA of 82.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate 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 Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate?
The CAS number of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate is 1024487-04-4.
What is the molecular formula of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate?
The molecular formula of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate is C16H19N3O3.
What is the molecular weight of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate?
The molecular weight of Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate is 301.14 g/mol.
Where can I buy Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate?
You can request a quote for Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(4-cyanophenyl)carbamoyl]piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.