2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide
TL;DR: 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide (CAS 130369-71-0) is a chemical compound with molecular formula C9H12N4O and molecular weight 192.1011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide
Also Known As: cyclopenta-1,3-diene,trichlorotitanium(1+), 2-(dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide, 2-dimethylamino-4,6-dimethyl-pyrimidine-5-carbonitrile N-oxide, n,n,4,6-tetramethyl-5-[(oxido-, E5-azanylidyne)methyl]pyrimidin-2-amine
Technical Specifications
| Molecular Formula | C9H12N4O |
| Molecular Weight | 192.1011 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 59.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.1011 Da |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
| SMILES | CC1=C(C(=NC(=N1)N(C)C)C)C#[N+][O-] |
| InChIKey | SFYRQISLPALYFC-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide
Property Insights of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide. With a topological polar surface area (TPSA) of 59.7 Ų, 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide has 0 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 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide?
The CAS number of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide is 130369-71-0.
What is the molecular formula of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide?
The molecular formula of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide is C9H12N4O.
What is the molecular weight of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide?
The molecular weight of 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide is 192.1011 g/mol.
Where can I buy 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide?
You can request a quote for 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide?
Yes, CoreyChem provides custom synthesis services for 2-(Dimethylamino)-4,6-dimethylpyrimidine-5-carbonitrile oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.