4,4-Dimethyl-5-methylidenepyrrolidin-2-one
TL;DR: 4,4-Dimethyl-5-methylidenepyrrolidin-2-one (CAS 23461-69-0) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-5-methylidenepyrrolidin-2-one
Also Known As: 4,4-dimethyl-5-methylidenepyrrolidin-2-one, 4,4-Dimethyl-5-methylene-2-pyrrolidinone, 3,3-dimethyl-2-methylene-5-pyrrolidone, 4,4-Dimethyl-5-methylene-2-pyrrolidinone #, 2-Pyrrolidinone, 4,4-dimethyl-5-methylidene-
| Molecular Formula | C7H11NO |
|---|---|
| Molecular Weight | 125.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.08406 |
| Heavy Atoms | 9 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 23461-69-0 |
|---|---|
| SMILES | CC1(CC(=O)NC1=C)C |
| InChIKey | DXAWLNRCYYPHTI-UHFFFAOYSA-N |
Product Overview
4,4-Dimethyl-5-methylidenepyrrolidin-2-one (CAS 23461-69-0), with molecular formula C7H11NO and molecular weight 125.08 g/mol. IUPAC: 4,4-dimethyl-5-methylidenepyrrolidin-2-one.
Chemical Property Profile of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one
Property Insights of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Dimethyl-5-methylidenepyrrolidin-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, 4,4-Dimethyl-5-methylidenepyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-5-methylidenepyrrolidin-2-one has 1 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 4,4-Dimethyl-5-methylidenepyrrolidin-2-one?
The CAS number of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one is 23461-69-0.
What is the molecular formula of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one?
The molecular formula of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one is C7H11NO.
What is the molecular weight of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one?
The molecular weight of 4,4-Dimethyl-5-methylidenepyrrolidin-2-one is 125.08 g/mol.
Where can I buy 4,4-Dimethyl-5-methylidenepyrrolidin-2-one?
You can request a quote for 4,4-Dimethyl-5-methylidenepyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-5-methylidenepyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-5-methylidenepyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.