![3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile structure](/static/products/526/52667-65-9.png)
3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile
TL;DR: 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile (CAS 52667-65-9) is a chemical compound with molecular formula C9H18N4 and molecular weight 182.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-aminoethyl)piperazin-1-yl]propanenitrile
Also Known As: 3-[4-(2-aminoethyl)piperazin-1-yl]propanenitrile, 4-(2-Aminoethyl)piperazine-1-propanenitrile, J2.779.943D, 3-(4-(2-aminoethyl)piperazin-1-yl)propanenitrile
| Molecular Formula | C9H18N4 |
|---|---|
| Molecular Weight | 182.15 g/mol |
| LogP | -0.52362 |
| Topological Polar Surface Area | 56.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.15315 |
| Heavy Atoms | 13 |
| Complexity | 166.94374 |
Chemical Identifiers
| CAS Number | 52667-65-9 |
|---|---|
| SMILES | C1CN(CCN1CCC#N)CCN |
Product Overview
3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile (CAS 52667-65-9), with molecular formula C9H18N4 and molecular weight 182.15 g/mol. IUPAC: 3-[4-(2-aminoethyl)piperazin-1-yl]propanenitrile.
Chemical Property Profile of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile
Property Insights of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile
The XLogP value of -0.52362 indicates that 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.29 Ų, 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile has 1 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-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile?
The CAS number of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile is 52667-65-9.
What is the molecular formula of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile?
The molecular formula of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile is C9H18N4.
What is the molecular weight of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile?
The molecular weight of 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile is 182.15 g/mol.
Where can I buy 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile?
You can request a quote for 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(2-Aminoethyl)piperazin-1-yl]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.