2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)
TL;DR: 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) (CAS 112483-22-4) is a chemical compound with molecular formula C14H20N2O5 and molecular weight 296.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(azetidin-1-yl)but-2-ynyl]-5-methylpyrrolidin-2-one;oxalic acid
Also Known As: 1-(4-(1-Azetidinyl)-2-butynyl)-5-methyl-2-pyrrolidinone ethanedioate, N-(4-Azetidinyl-2-butynyl)-5-methyl-2-pyrrolidone oxalate, 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1), 1-[4-(azetidin-1-yl)but-2-ynyl]-5-methylpyrrolidin-2-one; oxalic acid, Oxalic acid--1-[4-(azetidin-1-yl)but-2-yn-1-yl]-5-methylpyrrolidin-2-one (1/1)
| Molecular Formula | C14H20N2O5 |
|---|---|
| Molecular Weight | 296.14 g/mol |
| LogP | -0.138 |
| Topological Polar Surface Area | 98.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.1372 |
| Heavy Atoms | 21 |
| Complexity | 449.72015 |
Chemical Identifiers
| CAS Number | 112483-22-4 |
|---|---|
| SMILES | CC1CCC(=O)N1CC#CCN2CCC2.C(=O)(C(=O)O)O |
Product Overview
2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) (CAS 112483-22-4), with molecular formula C14H20N2O5 and molecular weight 296.14 g/mol. IUPAC: 1-[4-(azetidin-1-yl)but-2-ynyl]-5-methylpyrrolidin-2-one;oxalic acid.
Chemical Property Profile of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)
Property Insights of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)
The XLogP value of -0.138 indicates that 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1). Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) has 2 hydrogen bond donor(s) and 4 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-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)?
The CAS number of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) is 112483-22-4.
What is the molecular formula of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)?
The molecular formula of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) is C14H20N2O5.
What is the molecular weight of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)?
The molecular weight of 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) is 296.14 g/mol.
Where can I buy 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)?
You can request a quote for 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) 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-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 1-(4-(1-azetidinyl)-2-butynyl)-5-methyl-, ethanedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.