Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-
TL;DR: Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- (CAS 17380-42-6) is a chemical compound with molecular formula C13H15N3 and molecular weight 213.1266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(dimethylamino)ethyl]-1H-indole-5-carbonitrile
Also Known As: 5-Cyano-N,N-dimethyltryptamine, 3-(2-Dimethylamino)ethylindole-5-carbonitrile, 3-[2-(dimethylamino)ethyl]-1H-indole-5-carbonitrile, INDOLE-5-CARBONITRILE, 3-(2-DIMETHYLAMINOETHYL)-, 3-(2-dimethylamino-ethyl)-1H-indole-5-carbonitrile
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H15N3 |
| Molecular Weight | 213.1266 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.1266 Da |
| Heavy Atoms | 16 |
| Complexity | 278.0 |
| SMILES | CN(C)CCC1=CNC2=C1C=C(C=C2)C#N |
| InChIKey | DSNBRTOYUJFTAH-UHFFFAOYSA-N |
Chemical Property Profile of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-
Property Insights of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-. With a topological polar surface area (TPSA) of 42.8 Ų, Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- 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
What is the CAS number of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-?
The CAS number of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- is 17380-42-6.
What is the molecular formula of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-?
The molecular formula of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- is C13H15N3.
What is the molecular weight of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-?
The molecular weight of Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- is 213.1266 g/mol.
Where can I buy Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-?
You can request a quote for Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-?
Yes, CoreyChem provides custom synthesis services for Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.