TL;DR: N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide (CAS 1100118-65-7) is a chemical compound with molecular formula C20H24N2O2 and molecular weight 324.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-methyl-1-oxo-1-(2-phenylethylamino)butan-2-yl]benzamide
Also Known As: N-[2-methyl-1-(phenethylcarbamoyl)propyl]benzamide, N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide, N-[3-methyl-1-oxo-1-(phenethylamino)butan-2-yl]benzamide, N-[3-methyl-1-oxo-1-(2-phenylethylamino)butan-2-yl]benzamide, N-(2-methyl-1-{[(2-phenylethyl)amino]carbonyl}propyl)benzamide (non-preferred name)
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.18378 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 324.18378 Da |
| Heavy Atoms | 24 |
| Complexity | 396.0 |
| SMILES | CC(C)C(C(=O)NCCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2 |
| InChIKey | DTESANLGYTUAMU-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide is 1100118-65-7.
The molecular formula of N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide is C20H24N2O2.
The molecular weight of N-{3-methyl-1-oxo-1-[(2-phenylethyl)amino]butan-2-yl}benzamide is 324.18378 g/mol.
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