![3-[(4-Methylpiperazin-1-yl)methyl]aniline structure](/static/products/198/198281-55-9.png)
3-[(4-Methylpiperazin-1-yl)methyl]aniline
TL;DR: 3-[(4-Methylpiperazin-1-yl)methyl]aniline (CAS 198281-55-9) is a chemical compound with molecular formula C12H19N3 and molecular weight 205.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methylpiperazin-1-yl)methyl]aniline
Also Known As: 3-[(4-methylpiperazin-1-yl)methyl]aniline, 3-((4-methylpiperazin-1-yl)methyl)aniline, 3-[(4-methyl-1-piperazinyl)methyl]aniline, 3-(4-METHYL-PIPERAZIN-1-YLMETHYL)-ANILINE, Benzenamine, 3-[(4-methyl-1-piperazinyl)methyl]-
| Molecular Formula | C12H19N3 |
|---|---|
| Molecular Weight | 205.16 g/mol |
| LogP | 1.0162 |
| Topological Polar Surface Area | 32.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.1579 |
| Heavy Atoms | 15 |
| Complexity | 316.3982 |
Chemical Identifiers
| CAS Number | 198281-55-9 |
|---|---|
| SMILES | CN1CCN(CC1)CC2=CC(=CC=C2)N |
Product Overview
3-[(4-Methylpiperazin-1-yl)methyl]aniline (CAS 198281-55-9), with molecular formula C12H19N3 and molecular weight 205.16 g/mol. IUPAC: 3-[(4-methylpiperazin-1-yl)methyl]aniline.
Chemical Property Profile of 3-[(4-Methylpiperazin-1-yl)methyl]aniline
Property Insights of 3-[(4-Methylpiperazin-1-yl)methyl]aniline
The XLogP value of 1.0162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methylpiperazin-1-yl)methyl]aniline. With a topological polar surface area (TPSA) of 32.5 Ų, 3-[(4-Methylpiperazin-1-yl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methylpiperazin-1-yl)methyl]aniline 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 3-[(4-Methylpiperazin-1-yl)methyl]aniline?
The CAS number of 3-[(4-Methylpiperazin-1-yl)methyl]aniline is 198281-55-9.
What is the molecular formula of 3-[(4-Methylpiperazin-1-yl)methyl]aniline?
The molecular formula of 3-[(4-Methylpiperazin-1-yl)methyl]aniline is C12H19N3.
What is the molecular weight of 3-[(4-Methylpiperazin-1-yl)methyl]aniline?
The molecular weight of 3-[(4-Methylpiperazin-1-yl)methyl]aniline is 205.16 g/mol.
Where can I buy 3-[(4-Methylpiperazin-1-yl)methyl]aniline?
You can request a quote for 3-[(4-Methylpiperazin-1-yl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methylpiperazin-1-yl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methylpiperazin-1-yl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.