TL;DR: N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide (CAS 126909-76-0) is a chemical compound with molecular formula C12H13N7O and molecular weight 271.11816 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide
Also Known As: N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide, 3-(1,1-dimethyl-3-oxotriazan-2-yl)-5-methylcyclopentane-1,1,2,2-tetracarbonitrile, N',N'-dimethyl-N-((1S,4S)-2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous hydrazide
| Molecular Formula | C12H13N7O |
| Molecular Weight | 271.11816 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.11816 Da |
| Heavy Atoms | 20 |
| Complexity | 583.0 |
| SMILES | CC1CC(C(C1(C#N)C#N)(C#N)C#N)N(N=O)N(C)C |
| InChIKey | CXEYQPIYSIQXOU-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide. Following Lipinski's Rule of Five, N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide is 126909-76-0.
The molecular formula of N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide is C12H13N7O.
The molecular weight of N-(dimethylamino)-N-(2,2,3,3-tetracyano-4-methylcyclopentyl)nitrous amide is 271.11816 g/mol.
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