TL;DR: N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide (CAS 120226-55-3) is a chemical compound with molecular formula C12H16ClNO and molecular weight 225.09204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide
Also Known As: N-pivaloyl-p-chlorophenylmethylamine, N-(4-chlorobenzyl)-2,2-dimethylpropanamide, N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide, N-[(4-chlorophenyl)methyl]-2,2-dimethyl-propanamide
| Molecular Formula | C12H16ClNO |
| Molecular Weight | 225.09204 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.09204 Da |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
| SMILES | CC(C)(C)C(=O)NCC1=CC=C(C=C1)Cl |
| InChIKey | OTHXVGWZNGLBTB-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide is 120226-55-3.
The molecular formula of N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide is C12H16ClNO.
The molecular weight of N-[(4-chlorophenyl)methyl]-2,2-dimethylpropanamide is 225.09204 g/mol.
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