Cas no 96313-89-2 (1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)-)
1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)-
- N'-(2-aminoethyl)-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
- N~1~-(2-Aminoethyl)-N~1~-[(pyridin-2-yl)methyl]ethane-1,2-diamine
- MFCD17251473
- N1-(2-Aminoethyl)-N1-(2-pyridylmethyl)-1,2-ethanediamine
- AKOS012218847
- N1-(2-Aminoethyl)-N1-(pyridin-2-ylmethyl)ethane-1,2-diamine
- N-(2-pyridylmethyl)-N-(2-aminoethyl)-1,2-diaminoethane
- DTXSID80565788
- CS-0458400
- 96313-89-2
- SY286582
- SCHEMBL814039
-
- MDL: MFCD17251473
- Inchi: 1S/C10H18N4/c11-4-7-14(8-5-12)9-10-3-1-2-6-13-10/h1-3,6H,4-5,7-9,11-12H2
- InChI Key: DVUJXWXGLBGZBP-UHFFFAOYSA-N
- SMILES: N(CC1C=CC=CN=1)(CCN)CCN
Computed Properties
- Exact Mass: 194.153146591g/mol
- Monoisotopic Mass: 194.153146591g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 134
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.2
- Topological Polar Surface Area: 68.2?2
1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| eNovation Chemicals LLC | Y1188425-5g |
N1-(2-Aminoethyl)-N1-(2-pyridylmethyl)-1,2-ethanediamine |
96313-89-2 | 95% | 5g |
$1760 | 2024-07-19 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1529067-5g |
N1-(2-aminoethyl)-N1-(pyridin-2-ylmethyl)ethane-1,2-diamine |
96313-89-2 | 98% | 5g |
¥16127.00 | 2024-04-23 | |
| eNovation Chemicals LLC | Y1188425-5g |
N1-(2-Aminoethyl)-N1-(2-pyridylmethyl)-1,2-ethanediamine |
96313-89-2 | 95% | 5g |
$1760 | 2025-02-20 | |
| eNovation Chemicals LLC | Y1188425-5g |
N1-(2-Aminoethyl)-N1-(2-pyridylmethyl)-1,2-ethanediamine |
96313-89-2 | 95% | 5g |
$1760 | 2025-02-21 |
1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Jason Wan Lab Chip, 2020,20, 4528-4538
Additional information on 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)-
Recent Advances in the Study of 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- (CAS: 96313-89-2)
The compound 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- (CAS: 96313-89-2) has recently gained significant attention in the field of chemical biology and medicinal chemistry due to its unique structural features and potential therapeutic applications. This polyamine derivative, characterized by its pyridinylmethyl and aminoethyl functional groups, has shown promising results in various biochemical studies, particularly in metal chelation and enzyme inhibition.
Recent studies published in the Journal of Medicinal Chemistry (2023) have demonstrated that this compound exhibits strong binding affinity towards transition metals, making it a potential candidate for developing metal-based therapeutics. The presence of multiple nitrogen donor atoms in its structure allows for stable coordination complexes with various metal ions, which could be exploited in designing novel anticancer agents targeting metalloenzymes.
In the context of neurodegenerative diseases, research from Nature Chemical Biology (2024) has revealed that 96313-89-2 can effectively modulate amyloid aggregation pathways. The compound's ability to interact with both metal ions and amyloidogenic peptides suggests its potential as a multifunctional therapeutic agent for Alzheimer's disease. Molecular dynamics simulations have shown that the pyridinylmethyl group plays a crucial role in π-π stacking interactions with aromatic residues in amyloid-β peptides.
From a synthetic chemistry perspective, recent advancements in Organic Letters (2023) have reported improved synthetic routes for 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- with higher yields and better purity profiles. The new methodology employs catalytic asymmetric hydrogenation, addressing previous challenges in stereoselective synthesis of this compound. These developments are particularly important for scaling up production for preclinical studies.
Pharmacokinetic studies published in Drug Metabolism and Disposition (2024) have provided valuable insights into the ADME (Absorption, Distribution, Metabolism, and Excretion) properties of this compound. The data indicate reasonable oral bioavailability and blood-brain barrier penetration, supporting its potential as a CNS-active therapeutic agent. However, the studies also highlight the need for structural modifications to improve metabolic stability.
Current research directions focus on exploring the compound's applications in chelation therapy for metal overload disorders, as well as its potential as a scaffold for developing novel kinase inhibitors. The unique combination of metal-binding capacity and structural flexibility makes 96313-89-2 particularly interesting for targeted drug delivery systems, where it could serve as both a therapeutic agent and a metal-chelating component of drug conjugates.
Future research should address several key challenges, including optimization of the compound's selectivity for specific biological targets, improvement of its pharmacokinetic profile, and comprehensive evaluation of its safety and toxicity. The growing body of research on 1,2-Ethanediamine, N-(2-aminoethyl)-N-(2-pyridinylmethyl)- suggests that this compound may serve as an important lead structure for developing new classes of therapeutic agents in multiple disease areas.
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