tert-Butyl piperidine-3-carboxylate
TL;DR: tert-Butyl piperidine-3-carboxylate (CAS 1033430-04-4) is a chemical compound with molecular formula C10H19NO2 and molecular weight 185.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl piperidine-3-carboxylate
Also Known As: Tert-butyl Piperidine-3-carboxylate, tert-butyl nipecotate, 3-piperidinecarboxylic acid t-butyl ester, Tert-butylPiperidine-3-carboxylate, 1,1-Dimethylethyl 3-piperidinecarboxylate
Technical Specifications
| Molecular Formula | C10H19NO2 |
| Molecular Weight | 185.14159 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.14159 Da |
| Heavy Atoms | 13 |
| Complexity | 184.0 |
| SMILES | CC(C)(C)OC(=O)C1CCCNC1 |
| InChIKey | RHNAXBBEIVHVQT-UHFFFAOYSA-N |
Chemical Property Profile of tert-Butyl piperidine-3-carboxylate
Property Insights of tert-Butyl piperidine-3-carboxylate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl piperidine-3-carboxylate. With a topological polar surface area (TPSA) of 38.3 Ų, tert-Butyl piperidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl piperidine-3-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of tert-Butyl piperidine-3-carboxylate?
The CAS number of tert-Butyl piperidine-3-carboxylate is 1033430-04-4.
What is the molecular formula of tert-Butyl piperidine-3-carboxylate?
The molecular formula of tert-Butyl piperidine-3-carboxylate is C10H19NO2.
What is the molecular weight of tert-Butyl piperidine-3-carboxylate?
The molecular weight of tert-Butyl piperidine-3-carboxylate is 185.14159 g/mol.
Where can I buy tert-Butyl piperidine-3-carboxylate?
You can request a quote for tert-Butyl piperidine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tert-Butyl piperidine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for tert-Butyl piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.