2-Acetylpyrrolidine
TL;DR: 2-Acetylpyrrolidine (CAS 120966-82-7) is a chemical compound with molecular formula C6H11NO and molecular weight 113.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyrrolidin-2-ylethanone
Also Known As: 2-Acetylpyrrolidine, 2-Acetyl-pyrrolidine, 1-pyrrolidin-2-ylethanone, 1-(pyrrolidin-2-yl)ethan-1-one, 1-(PYRROLIDIN-2-YL)ETHANONE
| Molecular Formula | C6H11NO |
|---|---|
| Molecular Weight | 113.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 113.08406 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 120966-82-7 |
|---|---|
| SMILES | CC(=O)C1CCCN1 |
| InChIKey | FYCFJMPASVKULQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Acetylpyrrolidine (CAS 120966-82-7), with molecular formula C6H11NO and molecular weight 113.08 g/mol. IUPAC: 1-pyrrolidin-2-ylethanone.
Chemical Property Profile of 2-Acetylpyrrolidine
Property Insights of 2-Acetylpyrrolidine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetylpyrrolidine. With a topological polar surface area (TPSA) of 29.1 Ų, 2-Acetylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetylpyrrolidine has 1 hydrogen bond donor(s) and 2 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 2-Acetylpyrrolidine?
The CAS number of 2-Acetylpyrrolidine is 120966-82-7.
What is the molecular formula of 2-Acetylpyrrolidine?
The molecular formula of 2-Acetylpyrrolidine is C6H11NO.
What is the molecular weight of 2-Acetylpyrrolidine?
The molecular weight of 2-Acetylpyrrolidine is 113.08 g/mol.
Where can I buy 2-Acetylpyrrolidine?
You can request a quote for 2-Acetylpyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.