![1-[2-(4-Pyridinyl)ethyl]piperazine structure](/static/products/5345/53458-31-4.webp)
1-[2-(4-Pyridinyl)ethyl]piperazine
TL;DR: 1-[2-(4-Pyridinyl)ethyl]piperazine (CAS 53458-31-4) is a chemical compound with molecular formula C11H17N3 and molecular weight 191.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-pyridin-4-ylethyl)piperazine
Also Known As: 1-[2-(pyridin-4-yl)ethyl]piperazine, 1-(2-pyridin-4-ylethyl)piperazine, 1-(2-(Pyridin-4-yl)ethyl)piperazine, 1-(2-Pyridin-4-yl-ethyl)-piperazine, 1-[2-(4-Pyridinyl)ethyl]piperazine
| Molecular Formula | C11H17N3 |
|---|---|
| Molecular Weight | 191.14 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.14224 |
| Heavy Atoms | 14 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 53458-31-4 |
|---|---|
| SMILES | C1CN(CCN1)CCC2=CC=NC=C2 |
| InChIKey | PXJMEKXBONLMNG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[2-(4-Pyridinyl)ethyl]piperazine (CAS 53458-31-4), with molecular formula C11H17N3 and molecular weight 191.14 g/mol. IUPAC: 1-(2-pyridin-4-ylethyl)piperazine.
Chemical Property Profile of 1-[2-(4-Pyridinyl)ethyl]piperazine
Property Insights of 1-[2-(4-Pyridinyl)ethyl]piperazine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4-Pyridinyl)ethyl]piperazine. With a topological polar surface area (TPSA) of 28.2 Ų, 1-[2-(4-Pyridinyl)ethyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(4-Pyridinyl)ethyl]piperazine has 1 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 1-[2-(4-Pyridinyl)ethyl]piperazine?
The CAS number of 1-[2-(4-Pyridinyl)ethyl]piperazine is 53458-31-4.
What is the molecular formula of 1-[2-(4-Pyridinyl)ethyl]piperazine?
The molecular formula of 1-[2-(4-Pyridinyl)ethyl]piperazine is C11H17N3.
What is the molecular weight of 1-[2-(4-Pyridinyl)ethyl]piperazine?
The molecular weight of 1-[2-(4-Pyridinyl)ethyl]piperazine is 191.14 g/mol.
Where can I buy 1-[2-(4-Pyridinyl)ethyl]piperazine?
You can request a quote for 1-[2-(4-Pyridinyl)ethyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Pyridinyl)ethyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Pyridinyl)ethyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.