N-(2-methoxybenzyl)butanamide
TL;DR: N-(2-methoxybenzyl)butanamide (CAS 111088-39-2) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2-methoxyphenyl)methyl]butanamide
Also Known As: N-(2-methoxybenzyl)butanamide, N-[(2-methoxyphenyl)methyl]butanamide, Butanamide, N-[(2-methoxyphenyl)methyl]-
Technical Specifications
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.12593 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.12593 Da |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
| SMILES | CCCC(=O)NCC1=CC=CC=C1OC |
| InChIKey | HIXFASOHBYDACU-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-methoxybenzyl)butanamide
Property Insights of N-(2-methoxybenzyl)butanamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methoxybenzyl)butanamide. With a topological polar surface area (TPSA) of 38.3 Ų, N-(2-methoxybenzyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-methoxybenzyl)butanamide 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-(2-methoxybenzyl)butanamide?
The CAS number of N-(2-methoxybenzyl)butanamide is 111088-39-2.
What is the molecular formula of N-(2-methoxybenzyl)butanamide?
The molecular formula of N-(2-methoxybenzyl)butanamide is C12H17NO2.
What is the molecular weight of N-(2-methoxybenzyl)butanamide?
The molecular weight of N-(2-methoxybenzyl)butanamide is 207.12593 g/mol.
Where can I buy N-(2-methoxybenzyl)butanamide?
You can request a quote for N-(2-methoxybenzyl)butanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-methoxybenzyl)butanamide?
Yes, CoreyChem provides custom synthesis services for N-(2-methoxybenzyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.