Methyl 3-(aminomethyl)-1H-indole-2-carboxylate
TL;DR: Methyl 3-(aminomethyl)-1H-indole-2-carboxylate (CAS 865660-18-0) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(aminomethyl)-1H-indole-2-carboxylate
Also Known As: Methyl 3-(aminomethyl)-1H-indole-2-carboxylate, 3-aminomethyl-1h-indole-2-carboxylic acid methyl ester, 3X-0839, Methyl3-(aminomethyl)-1H-indole-2-carboxylate, 1H-Indole-2-carboxylicacid, 3-(aminomethyl)-, methyl ester
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.4132 |
| Topological Polar Surface Area | 68.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 502.25726 |
Chemical Identifiers
| CAS Number | 865660-18-0 |
|---|---|
| SMILES | COC(=O)C1=C(C2=CC=CC=C2N1)CN |
Product Overview
Methyl 3-(aminomethyl)-1H-indole-2-carboxylate (CAS 865660-18-0), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: methyl 3-(aminomethyl)-1H-indole-2-carboxylate.
Chemical Property Profile of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate
Property Insights of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate
The XLogP value of 1.4132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(aminomethyl)-1H-indole-2-carboxylate. The TPSA of 68.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(aminomethyl)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-(aminomethyl)-1H-indole-2-carboxylate has 2 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 Methyl 3-(aminomethyl)-1H-indole-2-carboxylate?
The CAS number of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate is 865660-18-0.
What is the molecular formula of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate?
The molecular formula of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate is C11H12N2O2.
What is the molecular weight of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate?
The molecular weight of Methyl 3-(aminomethyl)-1H-indole-2-carboxylate is 204.09 g/mol.
Where can I buy Methyl 3-(aminomethyl)-1H-indole-2-carboxylate?
You can request a quote for Methyl 3-(aminomethyl)-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(aminomethyl)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(aminomethyl)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.