1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile
TL;DR: 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile (CAS 130879-54-8) is a chemical compound with molecular formula C13H10N2O and molecular weight 210.07932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-2-oxo-5-phenylpyridine-3-carbonitrile
Also Known As: 1-methyl-2-oxo-5-phenylpyridine-3-carbonitrile, 1-methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile, 5J-313S, 1-methyl-2-oxo-5-phenyl-pyridine-3-carbonitrile, 1-methyl-2-oxo-5-phenyl-1,2-dihydropyridine-3-carbonitrile
Technical Specifications
| Molecular Formula | C13H10N2O |
| Molecular Weight | 210.07932 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.07932 Da |
| Heavy Atoms | 16 |
| Complexity | 405.0 |
| SMILES | CN1C=C(C=C(C1=O)C#N)C2=CC=CC=C2 |
| InChIKey | QDJMBXOGLZMLJK-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile
Property Insights of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile. With a topological polar surface area (TPSA) of 44.1 Ų, 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile?
The CAS number of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile is 130879-54-8.
What is the molecular formula of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile?
The molecular formula of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile is C13H10N2O.
What is the molecular weight of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile?
The molecular weight of 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile is 210.07932 g/mol.
Where can I buy 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile?
You can request a quote for 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.