1-methoxy-N-(4-nitrobenzyl)propan-2-amine
TL;DR: 1-methoxy-N-(4-nitrobenzyl)propan-2-amine (CAS 444907-60-2) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-N-[(4-nitrophenyl)methyl]propan-2-amine
Also Known As: 1-methoxy-N-(4-nitrobenzyl)propan-2-amine, 1-methoxy-N-[(4-nitrophenyl)methyl]propan-2-amine, CHEMBRDG-BB 5561295, (2-METHOXY-1-METHYLETHYL)(4-NITROBENZYL)AMINE, 1-methoxy-N-(4-nitrobenzyl)-2-propanamine
| Molecular Formula | C11H16N2O3 |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 1.7193 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.11609 |
| Heavy Atoms | 16 |
| Complexity | 337.58783 |
Chemical Identifiers
| CAS Number | 444907-60-2 |
|---|---|
| SMILES | CC(COC)NCC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
1-methoxy-N-(4-nitrobenzyl)propan-2-amine (CAS 444907-60-2), with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol. IUPAC: 1-methoxy-N-[(4-nitrophenyl)methyl]propan-2-amine.
Chemical Property Profile of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine
Property Insights of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine
The XLogP value of 1.7193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methoxy-N-(4-nitrobenzyl)propan-2-amine. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methoxy-N-(4-nitrobenzyl)propan-2-amine. Following Lipinski's Rule of Five, 1-methoxy-N-(4-nitrobenzyl)propan-2-amine has 1 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 1-methoxy-N-(4-nitrobenzyl)propan-2-amine?
The CAS number of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine is 444907-60-2.
What is the molecular formula of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine?
The molecular formula of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine is C11H16N2O3.
What is the molecular weight of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine?
The molecular weight of 1-methoxy-N-(4-nitrobenzyl)propan-2-amine is 224.12 g/mol.
Where can I buy 1-methoxy-N-(4-nitrobenzyl)propan-2-amine?
You can request a quote for 1-methoxy-N-(4-nitrobenzyl)propan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methoxy-N-(4-nitrobenzyl)propan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-methoxy-N-(4-nitrobenzyl)propan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.