Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate
TL;DR: Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate (CAS 683274-61-5) is a chemical compound with molecular formula C15H20N4O2 and molecular weight 288.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(5-cyano-2-pyridinyl)piperazine-1-carboxylate
Also Known As: Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate, 5-Cyano-2-[4-butoxycarbonyl(piperazino)]pyridine, J3.049.868B, 1-(5-Cyanopyridin-2-yl)piperazine, N-BOC protected, t-butyl-4-(5-cyanopyridin-2-yl)piperazin-1-carboxylate
| Molecular Formula | C15H20N4O2 |
|---|---|
| Molecular Weight | 288.16 g/mol |
| LogP | 2.01038 |
| Topological Polar Surface Area | 69.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.15863 |
| Heavy Atoms | 21 |
| Complexity | 534.2774 |
Chemical Identifiers
| CAS Number | 683274-61-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C=C2)C#N |
Product Overview
Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate (CAS 683274-61-5), with molecular formula C15H20N4O2 and molecular weight 288.16 g/mol. IUPAC: tert-butyl 4-(5-cyano-2-pyridinyl)piperazine-1-carboxylate.
Chemical Property Profile of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate
Property Insights of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate
The XLogP value of 2.01038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate. The TPSA of 69.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate has 0 hydrogen bond donor(s) and 5 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 Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate?
The CAS number of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate is 683274-61-5.
What is the molecular formula of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate?
The molecular formula of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate is C15H20N4O2.
What is the molecular weight of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate?
The molecular weight of Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate is 288.16 g/mol.
Where can I buy Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate?
You can request a quote for Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 4-(5-cyanopyridin-2-yl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.