N-(2-吡啶甲基)哌嗪-1-乙胺
TL;DR: N-(2-吡啶甲基)哌嗪-1-乙胺 (CAS 6957-14-8) is a chemical compound with molecular formula C12H20N4 and molecular weight 220.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-吡啶甲基)哌嗪-1-乙胺
2-piperazin-1-yl-N-(pyridin-2-ylmethyl)ethanamine
Also Known As: NCIStruc1_000352, NCIStruc2_000355, N-(2-Pyridylmethyl)piperazine-1-ethylamine, N-(2-Pyridinylmethyl)-1-piperazineethanamine, 2-(piperazin-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
| Molecular Formula | C12H20N4 |
|---|---|
| Molecular Weight | 220.17 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.1688 |
| Heavy Atoms | 16 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 6957-14-8 |
|---|---|
| SMILES | C1CN(CCN1)CCNCC2=CC=CC=N2 |
| InChIKey | KRQSKMDJMSKNLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-吡啶甲基)哌嗪-1-乙胺 (CAS 6957-14-8), with molecular formula C12H20N4 and molecular weight 220.17 g/mol. IUPAC: 2-piperazin-1-yl-N-(pyridin-2-ylmethyl)ethanamine.
Chemical Property Profile of N-(2-吡啶甲基)哌嗪-1-乙胺
Property Insights of N-(2-吡啶甲基)哌嗪-1-乙胺
The XLogP value of -0.4 indicates that N-(2-吡啶甲基)哌嗪-1-乙胺 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-(2-吡啶甲基)哌嗪-1-乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-吡啶甲基)哌嗪-1-乙胺 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
Frequently Asked Questions
What is the CAS number of N-(2-吡啶甲基)哌嗪-1-乙胺?
The CAS number of N-(2-吡啶甲基)哌嗪-1-乙胺 is 6957-14-8.
What is the molecular formula of N-(2-吡啶甲基)哌嗪-1-乙胺?
The molecular formula of N-(2-吡啶甲基)哌嗪-1-乙胺 is C12H20N4.
What is the molecular weight of N-(2-吡啶甲基)哌嗪-1-乙胺?
The molecular weight of N-(2-吡啶甲基)哌嗪-1-乙胺 is 220.17 g/mol.
Where can I buy N-(2-吡啶甲基)哌嗪-1-乙胺?
You can request a quote for N-(2-吡啶甲基)哌嗪-1-乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-吡啶甲基)哌嗪-1-乙胺?
Yes, KEHONG BIO provides custom synthesis services for N-(2-吡啶甲基)哌嗪-1-乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.