Benzenemethanamine, N-butyl-4-(dimethylamino)-
TL;DR: Benzenemethanamine, N-butyl-4-(dimethylamino)- (CAS 60509-54-8) is a chemical compound with molecular formula C13H22N2 and molecular weight 206.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(butylaminomethyl)-N,N-dimethylaniline
Also Known As: 4-[(butylamino)methyl]-n,n-dimethylaniline, Benzenemethanamine, N-butyl-4-(dimethylamino)-, (p-dimethylaminobenzylamino)butane, 4-(butylaminomethyl)-N,N-dimethylaniline, 4-(butylaminomethyl)-N,N-dimethyl-aniline
| Molecular Formula | C13H22N2 |
|---|---|
| Molecular Weight | 206.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 206.1783 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 60509-54-8 |
|---|---|
| SMILES | CCCCNCC1=CC=C(C=C1)N(C)C |
| InChIKey | DJQVAQHZNGBZGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanamine, N-butyl-4-(dimethylamino)- (CAS 60509-54-8), with molecular formula C13H22N2 and molecular weight 206.18 g/mol. IUPAC: 4-(butylaminomethyl)-N,N-dimethylaniline.
Chemical Property Profile of Benzenemethanamine, N-butyl-4-(dimethylamino)-
Property Insights of Benzenemethanamine, N-butyl-4-(dimethylamino)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, N-butyl-4-(dimethylamino)-. With a topological polar surface area (TPSA) of 15.3 Ų, Benzenemethanamine, N-butyl-4-(dimethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, N-butyl-4-(dimethylamino)- 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 Benzenemethanamine, N-butyl-4-(dimethylamino)-?
The CAS number of Benzenemethanamine, N-butyl-4-(dimethylamino)- is 60509-54-8.
What is the molecular formula of Benzenemethanamine, N-butyl-4-(dimethylamino)-?
The molecular formula of Benzenemethanamine, N-butyl-4-(dimethylamino)- is C13H22N2.
What is the molecular weight of Benzenemethanamine, N-butyl-4-(dimethylamino)-?
The molecular weight of Benzenemethanamine, N-butyl-4-(dimethylamino)- is 206.18 g/mol.
Where can I buy Benzenemethanamine, N-butyl-4-(dimethylamino)-?
You can request a quote for Benzenemethanamine, N-butyl-4-(dimethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, N-butyl-4-(dimethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, N-butyl-4-(dimethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.