6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile
TL;DR: 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile (CAS 107343-81-7) is a chemical compound with molecular formula C12H14N4O and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile
Also Known As: 2-Acetyl-6-methylpyridine, 6-acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile, 6-acetyl-3-amino-5-(1-pyrrolidinyl)-2-pyridinecarbonitrile, AO-079/15259298
| Molecular Formula | C12H14N4O |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 1.33828 |
| Topological Polar Surface Area | 83.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.11676 |
| Heavy Atoms | 17 |
| Complexity | 497.96246 |
Chemical Identifiers
| CAS Number | 107343-81-7 |
|---|---|
| SMILES | CC(=O)C1=C(C=C(C(=N1)C#N)N)N2CCCC2 |
Product Overview
6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile (CAS 107343-81-7), with molecular formula C12H14N4O and molecular weight 230.12 g/mol. IUPAC: 6-acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile.
Chemical Property Profile of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile
Property Insights of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile
The XLogP value of 1.33828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile. The TPSA of 83.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile. Following Lipinski's Rule of Five, 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile has 1 hydrogen bond donor(s) and 5 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 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile?
The CAS number of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile is 107343-81-7.
What is the molecular formula of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile?
The molecular formula of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile is C12H14N4O.
What is the molecular weight of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile?
The molecular weight of 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile is 230.12 g/mol.
Where can I buy 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile?
You can request a quote for 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Acetyl-3-amino-5-pyrrolidin-1-ylpyridine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.