4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile
TL;DR: 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile (CAS 104802-92-8) is a chemical compound with molecular formula C12H16N4 and molecular weight 216.1375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(cyclohexylamino)pyridine-3-carbonitrile
Also Known As: Nicotinonitrile, 2-amino-4-(cyclohexylamino)-, 2-Chloro-5-ethylpyridine hydrochloride, 2-Amino-4-(cyclohexylamino)-3-pyridinecarbonitrile, 2-amino-4-(cyclohexylamino)pyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 2-amino-4-(cyclohexylamino)-
Technical Specifications
| Molecular Formula | C12H16N4 |
| Molecular Weight | 216.1375 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 74.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.1375 Da |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
| SMILES | C1CCC(CC1)NC2=C(C(=NC=C2)N)C#N |
| InChIKey | XQHDQWVSSVBRDQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile
Property Insights of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile. Following Lipinski's Rule of Five, 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile?
The CAS number of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile is 104802-92-8.
What is the molecular formula of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile?
The molecular formula of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile is C12H16N4.
What is the molecular weight of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile?
The molecular weight of 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile is 216.1375 g/mol.
Where can I buy 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile?
You can request a quote for 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 4-(Cyclohexylamino)-2-imino-1,2-dihydropyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.