![{2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile structure](/static/products/798/79882-37-4.png)
{2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile
TL;DR: {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile (CAS 79882-37-4) is a chemical compound with molecular formula C15H19N3 and molecular weight 241.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl]acetonitrile
Also Known As: TimTec1_002851, BRD-K27129967-001-01-0, A2054/0086377, {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile, 2-(2-(2-(dimethylamino)ethyl)-5-methyl-1H-indol-3-yl)acetonitrile
| Molecular Formula | C15H19N3 |
|---|---|
| Molecular Weight | 241.16 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.1579 |
| Heavy Atoms | 18 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 79882-37-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2CC#N)CCN(C)C |
| InChIKey | AZBZDVGXVXNMCB-UHFFFAOYSA-N |
Product Overview
{2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile (CAS 79882-37-4), with molecular formula C15H19N3 and molecular weight 241.16 g/mol. IUPAC: 2-[2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl]acetonitrile.
Chemical Property Profile of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile
Property Insights of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile. With a topological polar surface area (TPSA) of 42.8 Ų, {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile 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-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile?
The CAS number of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile is 79882-37-4.
What is the molecular formula of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile?
The molecular formula of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile is C15H19N3.
What is the molecular weight of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile?
The molecular weight of {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile is 241.16 g/mol.
Where can I buy {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile?
You can request a quote for {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for {2-[2-(dimethylamino)ethyl]-5-methyl-1H-indol-3-yl}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.