5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile
TL;DR: 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile (CAS 303147-01-5) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-6-methyl-2-(propylamino)pyridine-3-carbonitrile
Also Known As: 5-acetyl-6-methyl-2-(propylamino)nicotinonitrile, 5-acetyl-6-methyl-2-(propylamino)pyridine-3-carbonitrile
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 2.2862 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 446.31247 |
Chemical Identifiers
| CAS Number | 303147-01-5 |
|---|---|
| SMILES | CCCNC1=NC(=C(C=C1C#N)C(=O)C)C |
Product Overview
5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile (CAS 303147-01-5), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: 5-acetyl-6-methyl-2-(propylamino)pyridine-3-carbonitrile.
Chemical Property Profile of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile
Property Insights of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile
The XLogP value of 2.2862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile. Following Lipinski's Rule of Five, 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile has 1 hydrogen bond donor(s) and 4 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 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile?
The CAS number of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile is 303147-01-5.
What is the molecular formula of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile?
The molecular formula of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile is C12H15N3O.
What is the molecular weight of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile?
The molecular weight of 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile is 217.12 g/mol.
Where can I buy 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile?
You can request a quote for 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-6-methyl-2-(propylamino)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.