TL;DR: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide (CAS 15889-92-6) is a chemical compound with molecular formula C14H21NO4 and molecular weight 267.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide
Also Known As: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide, AF-684/00246018, N~1~-(3,4-dimethoxyphenethyl)-4-hydroxybutanamide
| Molecular Formula | C14H21NO4 |
| Molecular Weight | 267.14706 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 267.14706 Da |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)CCCO)OC |
| InChIKey | MMZDBIIMJQSYKF-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide. Following Lipinski's Rule of Five, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide has 2 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 N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide is 15889-92-6.
The molecular formula of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide is C14H21NO4.
The molecular weight of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide is 267.14706 g/mol.
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