n-Butyl-N-methylaniline
TL;DR: n-Butyl-N-methylaniline (CAS 3416-49-7) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-N-methylaniline
Also Known As: n-Butyl-N-methylaniline, N-Methyl-N-butylaniline, N-Butyl-N-methyl-anilin, N-butyl-N-methyl-aniline, Benzenamine, N-butyl-N-methyl-
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 3416-49-7 |
|---|---|
| SMILES | CCCCN(C)C1=CC=CC=C1 |
| InChIKey | YLRCMGYQFGOZLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-Butyl-N-methylaniline (CAS 3416-49-7), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: N-butyl-N-methylaniline.
Chemical Property Profile of n-Butyl-N-methylaniline
Property Insights of n-Butyl-N-methylaniline
The XLogP value of 3.3 indicates that n-Butyl-N-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, n-Butyl-N-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-N-methylaniline has 0 hydrogen bond donor(s) and 1 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-Butyl-N-methylaniline?
The CAS number of n-Butyl-N-methylaniline is 3416-49-7.
What is the molecular formula of n-Butyl-N-methylaniline?
The molecular formula of n-Butyl-N-methylaniline is C11H17N.
What is the molecular weight of n-Butyl-N-methylaniline?
The molecular weight of n-Butyl-N-methylaniline is 163.14 g/mol.
Where can I buy n-Butyl-N-methylaniline?
You can request a quote for n-Butyl-N-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl-N-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-N-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.