N-(3-ethylphenyl)-3-oxobutanamide
TL;DR: N-(3-ethylphenyl)-3-oxobutanamide (CAS 152456-66-1) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-ethylphenyl)-3-oxobutanamide
Also Known As: N-(3-ethylphenyl)-3-oxobutanamide, starbld0022555, N-(3-ethylphenyl)-3-oxo-butanamide
Technical Specifications
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.11028 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.11028 Da |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
| SMILES | CCC1=CC(=CC=C1)NC(=O)CC(=O)C |
| InChIKey | SGFRWYKGJKSFAC-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-ethylphenyl)-3-oxobutanamide
Property Insights of N-(3-ethylphenyl)-3-oxobutanamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-ethylphenyl)-3-oxobutanamide. With a topological polar surface area (TPSA) of 46.2 Ų, N-(3-ethylphenyl)-3-oxobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-ethylphenyl)-3-oxobutanamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(3-ethylphenyl)-3-oxobutanamide?
The CAS number of N-(3-ethylphenyl)-3-oxobutanamide is 152456-66-1.
What is the molecular formula of N-(3-ethylphenyl)-3-oxobutanamide?
The molecular formula of N-(3-ethylphenyl)-3-oxobutanamide is C12H15NO2.
What is the molecular weight of N-(3-ethylphenyl)-3-oxobutanamide?
The molecular weight of N-(3-ethylphenyl)-3-oxobutanamide is 205.11028 g/mol.
Where can I buy N-(3-ethylphenyl)-3-oxobutanamide?
You can request a quote for N-(3-ethylphenyl)-3-oxobutanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-ethylphenyl)-3-oxobutanamide?
Yes, CoreyChem provides custom synthesis services for N-(3-ethylphenyl)-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.