N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine
TL;DR: N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine (CAS 887352-04-7) is a chemical compound with molecular formula C15H21NO4 and molecular weight 279.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxobutanamide
Also Known As: N-ACETOACETYL-N-METHYL-2-(3,4-DIMETHOXYPHENYL)ETHYLAMINE, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxobutanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxo-butanamide
| Molecular Formula | C15H21NO4 |
|---|---|
| Molecular Weight | 279.15 g/mol |
| LogP | 1.6838 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 279.14706 |
| Heavy Atoms | 20 |
| Complexity | 484.7619 |
Chemical Identifiers
| CAS Number | 887352-04-7 |
|---|---|
| SMILES | CC(=O)CC(=O)N(C)CCC1=CC(=C(C=C1)OC)OC |
Product Overview
N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine (CAS 887352-04-7), with molecular formula C15H21NO4 and molecular weight 279.15 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxobutanamide.
Chemical Property Profile of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine
Property Insights of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine
The XLogP value of 1.6838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine. With a topological polar surface area (TPSA) of 55.84 Ų, N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine has 0 hydrogen bond donor(s) and 4 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-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine?
The CAS number of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine is 887352-04-7.
What is the molecular formula of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine?
The molecular formula of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine is C15H21NO4.
What is the molecular weight of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine?
The molecular weight of N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine is 279.15 g/mol.
Where can I buy N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine?
You can request a quote for N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.