TL;DR: 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- (CAS 68966-35-8) is a chemical compound with molecular formula C11H21NO4 and molecular weight 231.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-hydroxy-3,3-bis(hydroxymethyl)-2-methylpentan-2-yl]prop-2-enamide
Also Known As: 2-Propenamide, N-(3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl)-, 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]-, N-[4-hydroxy-3,3-bis(hydroxymethyl)-2-methylpentan-2-yl]prop-2-enamide, n-[4-hydroxy-3,3-bis(hydroxymethyl)-2-methylpentan-2-yl]acrylamide, N-[3-Hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]propenamide
| Molecular Formula | C11H21NO4 |
| Molecular Weight | 231.14706 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 89.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 231.14706 Da |
| Heavy Atoms | 16 |
| Complexity | 259.0 |
| SMILES | CC(C(CO)(CO)C(C)(C)NC(=O)C=C)O |
| InChIKey | CPQILPVJBOJVJC-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]-. Following Lipinski's Rule of Five, 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- is 68966-35-8.
The molecular formula of 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- is C11H21NO4.
The molecular weight of 2-Propenamide, N-[3-hydroxy-2,2-bis(hydroxymethyl)-1,1-dimethylbutyl]- is 231.14706 g/mol.
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