2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide
TL;DR: 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide (CAS 445459-82-5) is a chemical compound with molecular formula C12H11N3O and molecular weight 213.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-cyano-2-methylindol-1-yl)acetamide
Also Known As: TimTec1_008494, 2-(3-cyano-2-methylindolyl)acetamide, 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide, BAS 06660940, 2-(3-cyano-2-methylindol-1-yl)acetamide
| Molecular Formula | C12H11N3O |
|---|---|
| Molecular Weight | 213.09 g/mol |
| LogP | 1.3067 |
| Topological Polar Surface Area | 71.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.09021 |
| Heavy Atoms | 16 |
| Complexity | 604.48676 |
Chemical Identifiers
| CAS Number | 445459-82-5 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1CC(=O)N)C#N |
Product Overview
2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide (CAS 445459-82-5), with molecular formula C12H11N3O and molecular weight 213.09 g/mol. IUPAC: 2-(3-cyano-2-methylindol-1-yl)acetamide.
Chemical Property Profile of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide
Property Insights of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide
The XLogP value of 1.3067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide. The TPSA of 71.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide. Following Lipinski's Rule of Five, 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide 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-(3-cyano-2-methyl-1H-indol-1-yl)acetamide?
The CAS number of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide is 445459-82-5.
What is the molecular formula of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide?
The molecular formula of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide is C12H11N3O.
What is the molecular weight of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide?
The molecular weight of 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide is 213.09 g/mol.
Where can I buy 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide?
You can request a quote for 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-cyano-2-methyl-1H-indol-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.