1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine
TL;DR: 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine (CAS 137052-08-5) is a chemical compound with molecular formula C11H20N2O3 and molecular weight 228.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-carbamoyl-2,2,5,5-tetramethylpyrrolidin-1-yl) acetate
Also Known As: 1-(Tetrahydro-2H-pyran-4-yl)ethanone, 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine, J1.277.170C, 1-Acetoxy-2,2,5,5-tetramethylpyrrolidine-3-carboxamide, 3-Carbamoyl-2,2,5,5-tetramethylpyrrolidin-1-yl acetate
| Molecular Formula | C11H20N2O3 |
|---|---|
| Molecular Weight | 228.15 g/mol |
| LogP | 0.8289 |
| Topological Polar Surface Area | 72.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.1474 |
| Heavy Atoms | 16 |
| Complexity | 323.19138 |
Chemical Identifiers
| CAS Number | 137052-08-5 |
|---|---|
| SMILES | CC(=O)ON1C(CC(C1(C)C)C(=O)N)(C)C |
Product Overview
1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine (CAS 137052-08-5), with molecular formula C11H20N2O3 and molecular weight 228.15 g/mol. IUPAC: (3-carbamoyl-2,2,5,5-tetramethylpyrrolidin-1-yl) acetate.
Chemical Property Profile of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine
Property Insights of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine
The XLogP value of 0.8289 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine. The TPSA of 72.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine. Following Lipinski's Rule of Five, 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine 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 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine?
The CAS number of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine is 137052-08-5.
What is the molecular formula of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine?
The molecular formula of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine is C11H20N2O3.
What is the molecular weight of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine?
The molecular weight of 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine is 228.15 g/mol.
Where can I buy 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine?
You can request a quote for 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetoxy-3-carbamoyl-2,2,5,5-tetramethylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.