3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium
TL;DR: 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium (CAS 1078203-94-7) is a chemical compound with molecular formula C13H22N3O+ and molecular weight 236.17628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-cyclohexyl-N-ethyl-3-methylimidazol-3-ium-1-carboxamide
Also Known As: starbld0032591, 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium
Technical Specifications
| Molecular Formula | C13H22N3O+ |
| Molecular Weight | 236.17628 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.17628 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | CCN(C1CCCCC1)C(=O)N2C=C[N+](=C2)C |
| InChIKey | WQPXQMXIUSDMSK-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium
Property Insights of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium. With a topological polar surface area (TPSA) of 29.1 Ų, 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium?
The CAS number of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium is 1078203-94-7.
What is the molecular formula of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium?
The molecular formula of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium is C13H22N3O+.
What is the molecular weight of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium?
The molecular weight of 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium is 236.17628 g/mol.
Where can I buy 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium?
You can request a quote for 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium?
Yes, CoreyChem provides custom synthesis services for 3-(Cyclohexyl(ethyl)carbamoyl)-1-methyl-1H-imidazol-3-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.