Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate
TL;DR: Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate (CAS 84145-25-5) is a chemical compound with molecular formula C15H19N3O2 and molecular weight 273.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-anilino-4-cyanopiperidine-1-carboxylate
Also Known As: EINECS 282-250-2, Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate, ethyl 4-anilino-4-cyanopiperidine-1-carboxylate, 4-Cyano-4-(phenylamino)-1-piperidinecarboxylic acid ethyl ester, 1-Piperidinecarboxylicacid, 4-cyano-4-(phenylamino)-, ethyl ester
| Molecular Formula | C15H19N3O2 |
|---|---|
| Molecular Weight | 273.15 g/mol |
| LogP | 2.61318 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.14774 |
| Heavy Atoms | 20 |
| Complexity | 487.59012 |
Chemical Identifiers
| CAS Number | 84145-25-5 |
|---|---|
| SMILES | CCOC(=O)N1CCC(CC1)(C#N)NC2=CC=CC=C2 |
Product Overview
Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate (CAS 84145-25-5), with molecular formula C15H19N3O2 and molecular weight 273.15 g/mol. IUPAC: ethyl 4-anilino-4-cyanopiperidine-1-carboxylate.
Chemical Property Profile of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate
Property Insights of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate
The XLogP value of 2.61318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-cyano-4-(phenylamino)piperidine-1-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 4-cyano-4-(phenylamino)piperidine-1-carboxylate?
The CAS number of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate is 84145-25-5.
What is the molecular formula of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate?
The molecular formula of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate is C15H19N3O2.
What is the molecular weight of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate?
The molecular weight of Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate is 273.15 g/mol.
Where can I buy Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate?
You can request a quote for Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.