3-((2-氨乙基)氨基)丙腈
TL;DR: 3-((2-氨乙基)氨基)丙腈 (CAS 22584-31-2) is a chemical compound with molecular formula C5H11N3 and molecular weight 113.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-((2-氨乙基)氨基)丙腈
3-(2-aminoethylamino)propanenitrile
Also Known As: 4,7-Diazaheptane-1-nitrile, Propanenitrile, 3-[(2-aminoethyl)amino]-, 3-(2-aminoethylamino)propanenitrile, N-cyanoethylethylenediamine, 2-(2-(Cyanoethyl)aminoethylamine
| Molecular Formula | C5H11N3 |
|---|---|
| Molecular Weight | 113.10 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 113.0953 |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 22584-31-2 |
|---|---|
| SMILES | C(CNCCN)C#N |
| InChIKey | NSQSYCXRUVZPKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-((2-氨乙基)氨基)丙腈 (CAS 22584-31-2), with molecular formula C5H11N3 and molecular weight 113.10 g/mol. IUPAC: 3-(2-aminoethylamino)propanenitrile.
Chemical Property Profile of 3-((2-氨乙基)氨基)丙腈
Property Insights of 3-((2-氨乙基)氨基)丙腈
The XLogP value of -1.5 indicates that 3-((2-氨乙基)氨基)丙腈 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-氨乙基)氨基)丙腈. Following Lipinski's Rule of Five, 3-((2-氨乙基)氨基)丙腈 has 2 hydrogen bond donor(s) and 3 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-氨乙基)氨基)丙腈?
The CAS number of 3-((2-氨乙基)氨基)丙腈 is 22584-31-2.
What is the molecular formula of 3-((2-氨乙基)氨基)丙腈?
The molecular formula of 3-((2-氨乙基)氨基)丙腈 is C5H11N3.
What is the molecular weight of 3-((2-氨乙基)氨基)丙腈?
The molecular weight of 3-((2-氨乙基)氨基)丙腈 is 113.10 g/mol.
Where can I buy 3-((2-氨乙基)氨基)丙腈?
You can request a quote for 3-((2-氨乙基)氨基)丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2-氨乙基)氨基)丙腈?
Yes, KEHONG BIO provides custom synthesis services for 3-((2-氨乙基)氨基)丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.