4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile
TL;DR: 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile (CAS 693254-24-9) is a chemical compound with molecular formula C12H15N3 and molecular weight 201.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-2-pyrrolidin-1-ylpyridine-3-carbonitrile
Also Known As: 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile, 4,6-dimethyl-2-(pyrrolidin-1-yl)pyridine-3-carbonitrile, 4,6-Dimethyl-2-pyrrolidin-1-ylnicotinonitrile, 8240AE, 4,6-dimethyl-2-pyrrolidin-1-ylpyridine-3-carbonitrile
| Molecular Formula | C12H15N3 |
|---|---|
| Molecular Weight | 201.13 g/mol |
| LogP | 2.17032 |
| Topological Polar Surface Area | 39.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.1266 |
| Heavy Atoms | 15 |
| Complexity | 411.61078 |
Chemical Identifiers
| CAS Number | 693254-24-9 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)N2CCCC2)C |
Product Overview
4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile (CAS 693254-24-9), with molecular formula C12H15N3 and molecular weight 201.13 g/mol. IUPAC: 4,6-dimethyl-2-pyrrolidin-1-ylpyridine-3-carbonitrile.
Chemical Property Profile of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile
Property Insights of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile
The XLogP value of 2.17032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile. With a topological polar surface area (TPSA) of 39.92 Ų, 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile has 0 hydrogen bond donor(s) and 3 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 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile?
The CAS number of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile is 693254-24-9.
What is the molecular formula of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile?
The molecular formula of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile is C12H15N3.
What is the molecular weight of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile?
The molecular weight of 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile is 201.13 g/mol.
Where can I buy 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile?
You can request a quote for 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.