![2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine structure](/static/products/2991/299168-85-7.webp)
2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine
TL;DR: 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine (CAS 299168-85-7) is a chemical compound with molecular formula C12H13F3N2O and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine
Also Known As: ZERO/001672, 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine, 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine, 2-[2-methyl-5-(trifluoromethoxy)indol-3-yl]ethylamine, 2-(2-Methyl-5-trifluoromethoxy-1H-indol-3-yl)-ethylamine
| Molecular Formula | C12H13F3N2O |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.098 |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 299168-85-7 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)OC(F)(F)F)CCN |
| InChIKey | DPXCGYZETKLAHZ-UHFFFAOYSA-N |
Product Overview
2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine (CAS 299168-85-7), with molecular formula C12H13F3N2O and molecular weight 258.10 g/mol. IUPAC: 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethanamine.
Chemical Property Profile of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine
Property Insights of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine. With a topological polar surface area (TPSA) of 51.0 Ų, 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine has 2 hydrogen bond donor(s) and 5 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 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine?
The CAS number of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine is 299168-85-7.
What is the molecular formula of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine?
The molecular formula of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine is C12H13F3N2O.
What is the molecular weight of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine?
The molecular weight of 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine is 258.10 g/mol.
Where can I buy 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine?
You can request a quote for 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.