N-(4-Pyridinylmethyl)-1-piperazineethanamine
TL;DR: N-(4-Pyridinylmethyl)-1-piperazineethanamine (CAS 118630-29-8) is a chemical compound with molecular formula C12H20N4 and molecular weight 220.1688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-piperazin-1-yl-N-(pyridin-4-ylmethyl)ethanamine
Also Known As: NCIStruc1_000514, NCIStruc2_000435, N-(4-Pyridinylmethyl)-1-piperazineethanamine, NCI60_021479, 2-(1-piperazinyl)-N-(4-pyridinylmethyl)ethanamine
Technical Specifications
| Molecular Formula | C12H20N4 |
| Molecular Weight | 220.1688 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 40.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.1688 Da |
| Heavy Atoms | 16 |
| Complexity | 174.0 |
| SMILES | C1CN(CCN1)CCNCC2=CC=NC=C2 |
| InChIKey | IBYTYGDHBRNVOK-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-Pyridinylmethyl)-1-piperazineethanamine
Property Insights of N-(4-Pyridinylmethyl)-1-piperazineethanamine
The XLogP value of -0.4 indicates that N-(4-Pyridinylmethyl)-1-piperazineethanamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.2 Ų, N-(4-Pyridinylmethyl)-1-piperazineethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Pyridinylmethyl)-1-piperazineethanamine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-Pyridinylmethyl)-1-piperazineethanamine?
The CAS number of N-(4-Pyridinylmethyl)-1-piperazineethanamine is 118630-29-8.
What is the molecular formula of N-(4-Pyridinylmethyl)-1-piperazineethanamine?
The molecular formula of N-(4-Pyridinylmethyl)-1-piperazineethanamine is C12H20N4.
What is the molecular weight of N-(4-Pyridinylmethyl)-1-piperazineethanamine?
The molecular weight of N-(4-Pyridinylmethyl)-1-piperazineethanamine is 220.1688 g/mol.
Where can I buy N-(4-Pyridinylmethyl)-1-piperazineethanamine?
You can request a quote for N-(4-Pyridinylmethyl)-1-piperazineethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-Pyridinylmethyl)-1-piperazineethanamine?
Yes, CoreyChem provides custom synthesis services for N-(4-Pyridinylmethyl)-1-piperazineethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.