2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole
TL;DR: 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole (CAS 130445-58-8) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-methoxy-1-methylindol-2-yl)methyl]prop-2-yn-1-amine
Also Known As: 2-Npammi, 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole, N-[(5-methoxy-1-methylindol-2-yl)methyl]prop-2-yn-1-amine, J1.328.404K, N-[(5-Methoxy-1-methyl-1H-indol-2-yl)methyl]-2-propyn-1-amine
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 130445-58-8 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)OC)C=C1CNCC#C |
| InChIKey | PHOSPXFMBUITGW-UHFFFAOYSA-N |
Product Overview
2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole (CAS 130445-58-8), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: N-[(5-methoxy-1-methylindol-2-yl)methyl]prop-2-yn-1-amine.
Chemical Property Profile of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole
Property Insights of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole. With a topological polar surface area (TPSA) of 26.2 Ų, 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole has 1 hydrogen bond donor(s) and 2 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-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole?
The CAS number of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole is 130445-58-8.
What is the molecular formula of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole?
The molecular formula of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole is C14H16N2O.
What is the molecular weight of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole?
The molecular weight of 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole is 228.13 g/mol.
Where can I buy 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole?
You can request a quote for 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-(2-Propynyl)aminomethyl)-1-methyl-5-methoxyindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.