TL;DR: N-(4-Chlorophenyl)-3-(diethylamino)butanamide (CAS 100915-63-7) is a chemical compound with molecular formula C14H21ClN2O and molecular weight 268.13425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-chlorophenyl)-3-(diethylamino)butanamide
Also Known As: 4'-Chloro-3-(diethylamino)butyranilide, N-(4-chlorophenyl)-3-(diethylamino)butanamide, BUTYRANILIDE, 4'-CHLORO-3-(DIETHYLAMINO)-, Butanamide,N-(4-chlorophenyl)-3-(diethylamino)-, 3-Diaethylamino-buttersaeure-(4-chlor-anilid)
| Molecular Formula | C14H21ClN2O |
| Molecular Weight | 268.13425 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.13425 Da |
| Heavy Atoms | 18 |
| Complexity | 248.0 |
| SMILES | CCN(CC)C(C)CC(=O)NC1=CC=C(C=C1)Cl |
| InChIKey | KIMNHXPDPHOUJS-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Chlorophenyl)-3-(diethylamino)butanamide. With a topological polar surface area (TPSA) of 32.3 Ų, N-(4-Chlorophenyl)-3-(diethylamino)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-3-(diethylamino)butanamide has 1 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-(4-Chlorophenyl)-3-(diethylamino)butanamide is 100915-63-7.
The molecular formula of N-(4-Chlorophenyl)-3-(diethylamino)butanamide is C14H21ClN2O.
The molecular weight of N-(4-Chlorophenyl)-3-(diethylamino)butanamide is 268.13425 g/mol.
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