N-(2-((1-Carboxyethyl)amino)ethyl)alanine
TL;DR: N-(2-((1-Carboxyethyl)amino)ethyl)alanine (CAS 6951-95-7) is a chemical compound with molecular formula C8H16N2O4 and molecular weight 204.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(1-carboxyethylamino)ethylamino]propanoic acid
Also Known As: NCIOpen2_007933, N-(2-((1-Carboxyethyl)amino)ethyl)alanine, N,N'-diisobutyl methyl carbamate, 2,2'-(ethylenediimino)-di-propionic acid, 3,6-Diazaoctanedioic acid, 2,7-dimethyl-
| Molecular Formula | C8H16N2O4 |
|---|---|
| Molecular Weight | 204.11 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 204.11101 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 6951-95-7 |
|---|---|
| SMILES | CC(C(=O)O)NCCNC(C)C(=O)O |
| InChIKey | YRXHNZVXWCZZEO-UHFFFAOYSA-N |
Product Overview
N-(2-((1-Carboxyethyl)amino)ethyl)alanine (CAS 6951-95-7), with molecular formula C8H16N2O4 and molecular weight 204.11 g/mol. IUPAC: 2-[2-(1-carboxyethylamino)ethylamino]propanoic acid.
Chemical Property Profile of N-(2-((1-Carboxyethyl)amino)ethyl)alanine
Property Insights of N-(2-((1-Carboxyethyl)amino)ethyl)alanine
The XLogP value of -5.2 indicates that N-(2-((1-Carboxyethyl)amino)ethyl)alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-((1-Carboxyethyl)amino)ethyl)alanine. Following Lipinski's Rule of Five, N-(2-((1-Carboxyethyl)amino)ethyl)alanine has 4 hydrogen bond donor(s) and 6 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 N-(2-((1-Carboxyethyl)amino)ethyl)alanine?
The CAS number of N-(2-((1-Carboxyethyl)amino)ethyl)alanine is 6951-95-7.
What is the molecular formula of N-(2-((1-Carboxyethyl)amino)ethyl)alanine?
The molecular formula of N-(2-((1-Carboxyethyl)amino)ethyl)alanine is C8H16N2O4.
What is the molecular weight of N-(2-((1-Carboxyethyl)amino)ethyl)alanine?
The molecular weight of N-(2-((1-Carboxyethyl)amino)ethyl)alanine is 204.11 g/mol.
Where can I buy N-(2-((1-Carboxyethyl)amino)ethyl)alanine?
You can request a quote for N-(2-((1-Carboxyethyl)amino)ethyl)alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((1-Carboxyethyl)amino)ethyl)alanine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((1-Carboxyethyl)amino)ethyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.