![2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- structure](/static/products/1124/112483-19-9.webp)
2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-
TL;DR: 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- (CAS 112483-19-9) is a chemical compound with molecular formula C13H22N2O and molecular weight 222.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(diethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one
Also Known As: 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-, 1-[4-(diethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one, 1-(4-diethylaminobut-2-ynyl)-5-methyl-pyrrolidin-2-one, N-<4-(diethylamino)-2-butynyl>-5-methyl-2-pyrrolidone, 1-[4-(DIETHYLAMINO)BUT-2-YN-1-YL]-5-METHYLPYRROLIDIN-2-ONE
| Molecular Formula | C13H22N2O |
|---|---|
| Molecular Weight | 222.17 g/mol |
| LogP | 1.3425 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.17322 |
| Heavy Atoms | 16 |
| Complexity | 286.04306 |
Chemical Identifiers
| CAS Number | 112483-19-9 |
|---|---|
| SMILES | CCN(CC)CC#CCN1C(CCC1=O)C |
Product Overview
2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- (CAS 112483-19-9), with molecular formula C13H22N2O and molecular weight 222.17 g/mol. IUPAC: 1-[4-(diethylamino)but-2-ynyl]-5-methylpyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-
Property Insights of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-
The XLogP value of 1.3425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-. With a topological polar surface area (TPSA) of 23.55 Ų, 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- 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 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-?
The CAS number of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- is 112483-19-9.
What is the molecular formula of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-?
The molecular formula of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- is C13H22N2O.
What is the molecular weight of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-?
The molecular weight of 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- is 222.17 g/mol.
Where can I buy 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-?
You can request a quote for 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 1-[4-(diethylamino)-2-butynyl]-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.