TL;DR: (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide (CAS 163957-48-0) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15248 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-acetamido-N-benzyl-3-methylbutanamide
Also Known As: N~2~-Acetyl-N-benzyl-D-valinamide, 2-acetamido-N-benzyl-3-methylbutanamide, (2R)-2-acetamido-N-benzyl-3-methylbutanamide, (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide
| Molecular Formula | C14H20N2O2 |
| Molecular Weight | 248.15248 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.15248 Da |
| Heavy Atoms | 18 |
| Complexity | 284.0 |
| SMILES | CC(C)[C@H](C(=O)NCC1=CC=CC=C1)NC(=O)C |
| InChIKey | FHPYYONXWDZUGV-CYBMUJFWSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide. With a topological polar surface area (TPSA) of 58.2 Ų, (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide 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 (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide is 163957-48-0.
The molecular formula of (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide is C14H20N2O2.
The molecular weight of (2R)-2-(Acetylamino)-3-methyl-N-(phenylmethyl)butanamide is 248.15248 g/mol.
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