1-(1-Methyl-1H-indol-2-yl)ethanone
TL;DR: 1-(1-Methyl-1H-indol-2-yl)ethanone (CAS 16498-68-3) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-methylindol-2-yl)ethanone
Also Known As: 1-(1-Methyl-1H-indol-2-yl)ethanone, 1-Methyl-2-acetylindole, 1-(1-methylindol-2-yl)ethanone, N-methyl-2-acetylindole, 1-(1-methyl-1h-indol-2-yl)-ethanone
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 16498-68-3 |
|---|---|
| SMILES | CC(=O)C1=CC2=CC=CC=C2N1C |
| InChIKey | SVUKISNBRDNDMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(1-Methyl-1H-indol-2-yl)ethanone (CAS 16498-68-3), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 1-(1-methylindol-2-yl)ethanone.
Chemical Property Profile of 1-(1-Methyl-1H-indol-2-yl)ethanone
Property Insights of 1-(1-Methyl-1H-indol-2-yl)ethanone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Methyl-1H-indol-2-yl)ethanone. With a topological polar surface area (TPSA) of 22.0 Ų, 1-(1-Methyl-1H-indol-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Methyl-1H-indol-2-yl)ethanone has 0 hydrogen bond donor(s) and 1 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-(1-Methyl-1H-indol-2-yl)ethanone?
The CAS number of 1-(1-Methyl-1H-indol-2-yl)ethanone is 16498-68-3.
What is the molecular formula of 1-(1-Methyl-1H-indol-2-yl)ethanone?
The molecular formula of 1-(1-Methyl-1H-indol-2-yl)ethanone is C11H11NO.
What is the molecular weight of 1-(1-Methyl-1H-indol-2-yl)ethanone?
The molecular weight of 1-(1-Methyl-1H-indol-2-yl)ethanone is 173.08 g/mol.
Where can I buy 1-(1-Methyl-1H-indol-2-yl)ethanone?
You can request a quote for 1-(1-Methyl-1H-indol-2-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Methyl-1H-indol-2-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Methyl-1H-indol-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.