N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline
TL;DR: N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline (CAS 127598-85-0) is a chemical compound with molecular formula C16H20N2 and molecular weight 240.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(dimethylamino)phenyl]methyl]-4-methylaniline
Also Known As: N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline, N-(4-(Dimethylamino)benzyl)-p-methylaniline, J3.634.174B, N,N-Dimethyl-4-((p-tolylamino)methyl)aniline, N,N-Dimethyl-4-(4-toluidinomethyl)aniline #
| Molecular Formula | C16H20N2 |
|---|---|
| Molecular Weight | 240.16 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.16264 |
| Heavy Atoms | 18 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 127598-85-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC2=CC=C(C=C2)N(C)C |
| InChIKey | MPIIVCDMKHOLLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline (CAS 127598-85-0), with molecular formula C16H20N2 and molecular weight 240.16 g/mol. IUPAC: N-[[4-(dimethylamino)phenyl]methyl]-4-methylaniline.
Chemical Property Profile of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline
Property Insights of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline
The XLogP value of 3.9 indicates that N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline has 1 hydrogen bond donor(s) and 2 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,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline?
The CAS number of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline is 127598-85-0.
What is the molecular formula of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline?
The molecular formula of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline is C16H20N2.
What is the molecular weight of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline?
The molecular weight of N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline is 240.16 g/mol.
Where can I buy N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline?
You can request a quote for N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-{[(4-methylphenyl)amino]methyl}aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.