![(5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one structure](/static/products/986/98612-63-6.png)
(5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one
TL;DR: (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one (CAS 98612-63-6) is a chemical compound with molecular formula C11H18N2O and molecular weight 194.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S)-1-[4-(dimethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one
Also Known As: (-)-AKS 19, (+-)-1-(4-(Dimethylamino)-2-butynyl)-5-methyl-2-pyrrolidinone, (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one, (5S)-1-[4-(dimethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one
| Molecular Formula | C11H18N2O |
|---|---|
| Molecular Weight | 194.14 g/mol |
| LogP | 0.5623 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.1419 |
| Heavy Atoms | 14 |
| Complexity | 262.19644 |
Chemical Identifiers
| CAS Number | 98612-63-6 |
|---|---|
| SMILES | C[C@H]1CCC(=O)N1CC#CCN(C)C |
Product Overview
(5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one (CAS 98612-63-6), with molecular formula C11H18N2O and molecular weight 194.14 g/mol. IUPAC: (5S)-1-[4-(dimethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one.
Chemical Property Profile of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one
Property Insights of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one
The XLogP value of 0.5623 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one. With a topological polar surface area (TPSA) of 23.55 Ų, (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one has 0 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 (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one?
The CAS number of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one is 98612-63-6.
What is the molecular formula of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one?
The molecular formula of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one is C11H18N2O.
What is the molecular weight of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one?
The molecular weight of (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one is 194.14 g/mol.
Where can I buy (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one?
You can request a quote for (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for (5S)-1-[4-(dimethylamino)but-2-yn-1-yl]-5-methylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.