N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine
TL;DR: N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine (CAS 53486-20-7) is a chemical compound with molecular formula C14H21N3O5 and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-N-(2-morpholin-4-ylethyl)-2-nitroaniline
Also Known As: 4-Morpholineethanamine, N-(4,5-dimethoxy-2-nitrophenyl)-, N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine, 4,5-dimethoxy-n-[2-(morpholin-4-yl)ethyl]-2-nitroaniline, 4,5-dimethoxy-N-(2-morpholin-4-ylethyl)-2-nitroaniline, BRN 4734516
| Molecular Formula | C14H21N3O5 |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.14813 |
| Heavy Atoms | 22 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 53486-20-7 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)NCCN2CCOCC2)[N+](=O)[O-])OC |
| InChIKey | PQZPBTFHHZUHET-UHFFFAOYSA-N |
Product Overview
N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine (CAS 53486-20-7), with molecular formula C14H21N3O5 and molecular weight 311.15 g/mol. IUPAC: 4,5-dimethoxy-N-(2-morpholin-4-ylethyl)-2-nitroaniline.
Chemical Property Profile of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine
Property Insights of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine. Following Lipinski's Rule of Five, N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine has 1 hydrogen bond donor(s) and 7 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-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine?
The CAS number of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine is 53486-20-7.
What is the molecular formula of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine?
The molecular formula of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine is C14H21N3O5.
What is the molecular weight of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine?
The molecular weight of N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine is 311.15 g/mol.
Where can I buy N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine?
You can request a quote for N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5-Dimethoxy-2-nitrophenyl)-4-morpholineethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.