![1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester structure](/static/products/6301/6301-80-0.webp)
1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester
TL;DR: 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester (CAS 6301-80-0) is a chemical compound with molecular formula C14H18N2O2 and molecular weight 246.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(dimethylamino)methyl]-1H-indole-2-carboxylate
Also Known As: ethyl 3-(dimethylaminomethyl)-1H-indole-2-carboxylate, ethyl 3-[(dimethylamino)methyl]-1H-indole-2-carboxylate, 1h-indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester, 3-Dimethylaminomethyl-indol-2-carbonsaeure-aethylester, 3-Dimethylaminomethyl-1H-indole-2-carboxylic acid ethyl ester
| Molecular Formula | C14H18N2O2 |
|---|---|
| Molecular Weight | 246.14 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.13683 |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 6301-80-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2N1)CN(C)C |
| InChIKey | XCLWRWMGOGPGDS-UHFFFAOYSA-N |
Product Overview
1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester (CAS 6301-80-0), with molecular formula C14H18N2O2 and molecular weight 246.14 g/mol. IUPAC: ethyl 3-[(dimethylamino)methyl]-1H-indole-2-carboxylate.
Chemical Property Profile of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester
Property Insights of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester. With a topological polar surface area (TPSA) of 45.3 Ų, 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester 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 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester?
The CAS number of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester is 6301-80-0.
What is the molecular formula of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester?
The molecular formula of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester is C14H18N2O2.
What is the molecular weight of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester?
The molecular weight of 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester is 246.14 g/mol.
Where can I buy 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester?
You can request a quote for 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1h-Indole-2-carboxylic acid, 3-[(dimethylamino)methyl]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.