1-(But-1-enyl)pyrrolidin-2-one
TL;DR: 1-(But-1-enyl)pyrrolidin-2-one (CAS 117593-76-7) is a chemical compound with molecular formula C8H13NO and molecular weight 139.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-but-1-enylpyrrolidin-2-one
Also Known As: 1-(but-1-enyl)pyrrolidin-2-one, 1-(but-1-enyl)-pyrrolidin-2-one, 1-(But-1-Enyl) Pyrrolidin-2-One, 1-(1-BUTEN-1-YL)-2-PYRROLIDINONE
| Molecular Formula | C8H13NO |
|---|---|
| Molecular Weight | 139.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.09972 |
| Heavy Atoms | 10 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 117593-76-7 |
|---|---|
| SMILES | CCC=CN1CCCC1=O |
| InChIKey | FMAQXEBCTUCOBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(But-1-enyl)pyrrolidin-2-one (CAS 117593-76-7), with molecular formula C8H13NO and molecular weight 139.10 g/mol. IUPAC: 1-but-1-enylpyrrolidin-2-one.
Chemical Property Profile of 1-(But-1-enyl)pyrrolidin-2-one
Property Insights of 1-(But-1-enyl)pyrrolidin-2-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(But-1-enyl)pyrrolidin-2-one. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(But-1-enyl)pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(But-1-enyl)pyrrolidin-2-one has 0 hydrogen bond donor(s) and 1 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-(But-1-enyl)pyrrolidin-2-one?
The CAS number of 1-(But-1-enyl)pyrrolidin-2-one is 117593-76-7.
What is the molecular formula of 1-(But-1-enyl)pyrrolidin-2-one?
The molecular formula of 1-(But-1-enyl)pyrrolidin-2-one is C8H13NO.
What is the molecular weight of 1-(But-1-enyl)pyrrolidin-2-one?
The molecular weight of 1-(But-1-enyl)pyrrolidin-2-one is 139.10 g/mol.
Where can I buy 1-(But-1-enyl)pyrrolidin-2-one?
You can request a quote for 1-(But-1-enyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(But-1-enyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(But-1-enyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.