3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile
TL;DR: 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile (CAS 2223-89-4) is a chemical compound with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methylanilino]propanenitrile
Also Known As: 3-[[2-(2,5-Dioxopyrrolidin-1-yl)ethyl](3-methylphenyl)amino]propiononitrile, Propanenitrile, 3-[[2-(2,5-dioxo-1-pyrrolidinyl)ethyl](3-methylphenyl)amino]-, 3-{[2-(2,5-dioxopyrrolidin-1-yl)ethyl](3-methylphenyl)amino}propanenitrile, N-(2-(N-(2-CYANOETHYL)-3-METHYLANILINO)ETHYL)SUCCINIMIDE, Propanenitrile, 3-((2-(2,5-dioxo-1-pyrrolidinyl)ethyl)(3-methylphenyl)amino)-
| Molecular Formula | C16H19N3O2 |
|---|---|
| Molecular Weight | 285.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.14774 |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 2223-89-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N(CCC#N)CCN2C(=O)CCC2=O |
| InChIKey | SQZMCALHUSFSRR-UHFFFAOYSA-N |
Product Overview
3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile (CAS 2223-89-4), with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol. IUPAC: 3-[N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methylanilino]propanenitrile.
Chemical Property Profile of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile
Property Insights of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile. Following Lipinski's Rule of Five, 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile has 0 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 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile?
The CAS number of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile is 2223-89-4.
What is the molecular formula of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile?
The molecular formula of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile is C16H19N3O2.
What is the molecular weight of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile?
The molecular weight of 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile is 285.15 g/mol.
Where can I buy 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile?
You can request a quote for 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-((2-(2,5-Dioxopyrrolidin-1-yl)ethyl)(3-methylphenyl)amino)propiononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.