Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-
TL;DR: Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- (CAS 52059-40-2) is a chemical compound with molecular formula C17H20N2O2 and molecular weight 284.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-[2-(3-nitrophenyl)ethyl]-2-phenylethanamine
Also Known As: Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-, methyl[2-(3-nitrophenyl)ethyl](2-phenylethyl)amine, N-Methyl-3-nitro-N-(2-phenylethyl)benzeneethanamine, N-methyl -3-nitro-N-(2-phenylethyl )benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-benzeneethanamine
| Molecular Formula | C17H20N2O2 |
|---|---|
| Molecular Weight | 284.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.15247 |
| Heavy Atoms | 21 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 52059-40-2 |
|---|---|
| SMILES | CN(CCC1=CC=CC=C1)CCC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | DALWIIPSKXSKHY-UHFFFAOYSA-N |
Product Overview
Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- (CAS 52059-40-2), with molecular formula C17H20N2O2 and molecular weight 284.15 g/mol. IUPAC: N-methyl-N-[2-(3-nitrophenyl)ethyl]-2-phenylethanamine.
Chemical Property Profile of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-
Property Insights of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-
The XLogP value of 4.5 indicates that Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- has 0 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 Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-?
The CAS number of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- is 52059-40-2.
What is the molecular formula of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-?
The molecular formula of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- is C17H20N2O2.
What is the molecular weight of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-?
The molecular weight of Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- is 284.15 g/mol.
Where can I buy Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-?
You can request a quote for Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, N-methyl-3-nitro-N-(2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.