6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
TL;DR: 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile (CAS 56304-65-5) is a chemical compound with molecular formula C16H18N2O and molecular weight 254.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-adamantyl)-2-oxo-1H-pyridine-3-carbonitrile
Also Known As: 6-(1-adamantyl)-3-cyano-2-hydroxypyridine, 6-(1-adamantyl)-3-cyanopyridin-2(1h)-one, 6-(1-adamantyl)-2-oxo-1H-pyridine-3-carbonitrile, 6-((3r,5r,7r)-adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
| Molecular Formula | C16H18N2O |
|---|---|
| Molecular Weight | 254.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.1419 |
| Heavy Atoms | 19 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 56304-65-5 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=CC=C(C(=O)N4)C#N |
| InChIKey | UYBXUZBWQBNSNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile (CAS 56304-65-5), with molecular formula C16H18N2O and molecular weight 254.14 g/mol. IUPAC: 6-(1-adamantyl)-2-oxo-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Property Insights of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
The XLogP value of 3.0 indicates that 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile 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 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The CAS number of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile is 56304-65-5.
What is the molecular formula of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The molecular formula of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile is C16H18N2O.
What is the molecular weight of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile?
The molecular weight of 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile is 254.14 g/mol.
Where can I buy 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile?
You can request a quote for 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-((3r,5r,7r)-Adamantan-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.