1,4-Piperazinedipropanenitrile
TL;DR: 1,4-Piperazinedipropanenitrile (CAS 4159-11-9) is a chemical compound with molecular formula C10H16N4 and molecular weight 192.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-cyanoethyl)piperazin-1-yl]propanenitrile
Also Known As: 1,4-Piperazinedipropanenitrile, 1,4-Piperazinedipropionitrile, Bis(cyanoethyl)piperazine, 1,4-Bis(2-cyanoethyl)piperazine, Piperazine-1,4-dipropiononitrile
| Molecular Formula | C10H16N4 |
|---|---|
| Molecular Weight | 192.14 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.1375 |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 4159-11-9 |
|---|---|
| SMILES | C1CN(CCN1CCC#N)CCC#N |
| InChIKey | QXQYJEMSNUMUPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Piperazinedipropanenitrile (CAS 4159-11-9), with molecular formula C10H16N4 and molecular weight 192.14 g/mol. IUPAC: 3-[4-(2-cyanoethyl)piperazin-1-yl]propanenitrile.
Chemical Property Profile of 1,4-Piperazinedipropanenitrile
Property Insights of 1,4-Piperazinedipropanenitrile
The XLogP value of -0.5 indicates that 1,4-Piperazinedipropanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.1 Ų, 1,4-Piperazinedipropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Piperazinedipropanenitrile 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 1,4-Piperazinedipropanenitrile?
The CAS number of 1,4-Piperazinedipropanenitrile is 4159-11-9.
What is the molecular formula of 1,4-Piperazinedipropanenitrile?
The molecular formula of 1,4-Piperazinedipropanenitrile is C10H16N4.
What is the molecular weight of 1,4-Piperazinedipropanenitrile?
The molecular weight of 1,4-Piperazinedipropanenitrile is 192.14 g/mol.
Where can I buy 1,4-Piperazinedipropanenitrile?
You can request a quote for 1,4-Piperazinedipropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Piperazinedipropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Piperazinedipropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.