![N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide structure](/static/products/811/81165-56-2.png)
N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide
TL;DR: N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide (CAS 81165-56-2) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide
Also Known As: N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide, Trichloro(2-methylbutyl)silane, N-[2-(3,4-Dimethoxyphenyl)ethyl]butyramide, N-[2-(3,4-Dimethoxyphenyl)ethyl]butanimidic acid
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 81165-56-2 |
|---|---|
| SMILES | CCCC(=O)NCCC1=CC(=C(C=C1)OC)OC |
| InChIKey | UOQDCHMQQBSEAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide (CAS 81165-56-2), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide.
Chemical Property Profile of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide
Property Insights of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide. With a topological polar surface area (TPSA) of 47.6 Ų, N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide?
The CAS number of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide is 81165-56-2.
What is the molecular formula of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide?
The molecular formula of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide is C14H21NO3.
What is the molecular weight of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide?
The molecular weight of N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide is 251.15 g/mol.
Where can I buy N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide?
You can request a quote for N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.