TL;DR: 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso- (CAS 145439-03-8) is a chemical compound with molecular formula C7H11N5O2 and molecular weight 197.09128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,3-dimethyl-5-(methylamino)-N-nitrosoimidazole-4-carboxamide
Also Known As: Mononitrosamidocaffeidine, Mononitrosoamidocaffeidine, 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso-, N,1-Dimethyl-4-(methylamino)-N-nitroso-1H-imidazole-5-carboxamide, N,3-dimethyl-5-(methylamino)-N-nitrosoimidazole-4-carboxamide
| Molecular Formula | C7H11N5O2 |
| Molecular Weight | 197.09128 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 79.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.09128 Da |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
| SMILES | CNC1=C(N(C=N1)C)C(=O)N(C)N=O |
| InChIKey | PVKHZNDLTCEMLZ-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso-. The TPSA of 79.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso-. Following Lipinski's Rule of Five, 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso- is 145439-03-8.
The molecular formula of 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso- is C7H11N5O2.
The molecular weight of 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-N-nitroso- is 197.09128 g/mol.
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