N1,N1-diethyl-3-methoxybenzene-1,4-diamine
TL;DR: N1,N1-diethyl-3-methoxybenzene-1,4-diamine (CAS 2165-85-7) is a chemical compound with molecular formula C11H18N2O and molecular weight 194.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,4-N-diethyl-2-methoxybenzene-1,4-diamine
Also Known As: N1,N1-diethyl-3-methoxybenzene-1,4-diamine, N4,N4-diethyl-2-methoxy-p-phenylenediamine, 4-N,4-N-diethyl-2-methoxybenzene-1,4-diamine
| Molecular Formula | C11H18N2O |
|---|---|
| Molecular Weight | 194.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 38.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.1419 |
| Heavy Atoms | 14 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 2165-85-7 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N)OC |
| InChIKey | LGMWBTURBRPNCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N1,N1-diethyl-3-methoxybenzene-1,4-diamine (CAS 2165-85-7), with molecular formula C11H18N2O and molecular weight 194.14 g/mol. IUPAC: 4-N,4-N-diethyl-2-methoxybenzene-1,4-diamine.
Chemical Property Profile of N1,N1-diethyl-3-methoxybenzene-1,4-diamine
Property Insights of N1,N1-diethyl-3-methoxybenzene-1,4-diamine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1,N1-diethyl-3-methoxybenzene-1,4-diamine. With a topological polar surface area (TPSA) of 38.5 Ų, N1,N1-diethyl-3-methoxybenzene-1,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N1-diethyl-3-methoxybenzene-1,4-diamine 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 N1,N1-diethyl-3-methoxybenzene-1,4-diamine?
The CAS number of N1,N1-diethyl-3-methoxybenzene-1,4-diamine is 2165-85-7.
What is the molecular formula of N1,N1-diethyl-3-methoxybenzene-1,4-diamine?
The molecular formula of N1,N1-diethyl-3-methoxybenzene-1,4-diamine is C11H18N2O.
What is the molecular weight of N1,N1-diethyl-3-methoxybenzene-1,4-diamine?
The molecular weight of N1,N1-diethyl-3-methoxybenzene-1,4-diamine is 194.14 g/mol.
Where can I buy N1,N1-diethyl-3-methoxybenzene-1,4-diamine?
You can request a quote for N1,N1-diethyl-3-methoxybenzene-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N1-diethyl-3-methoxybenzene-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1,N1-diethyl-3-methoxybenzene-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.