N-methyl-N-(oxiran-2-ylmethyl)aniline
TL;DR: N-methyl-N-(oxiran-2-ylmethyl)aniline (CAS 14236-04-5) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(oxiran-2-ylmethyl)aniline
Also Known As: Glycidylmethylaniline, N-methyl-N-(oxiran-2-ylmethyl)aniline, (2,3-Epoxypropyl)methylphenylamine, N-Methyl-N-phenyloxiranemethanamine, n-methyl-n-(2-oxiranylmethyl)aniline
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 14236-04-5 |
|---|---|
| SMILES | CN(CC1CO1)C2=CC=CC=C2 |
| InChIKey | NEKXUGUSHFDYLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-methyl-N-(oxiran-2-ylmethyl)aniline (CAS 14236-04-5), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-methyl-N-(oxiran-2-ylmethyl)aniline.
Chemical Property Profile of N-methyl-N-(oxiran-2-ylmethyl)aniline
Property Insights of N-methyl-N-(oxiran-2-ylmethyl)aniline
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N-(oxiran-2-ylmethyl)aniline. With a topological polar surface area (TPSA) of 15.8 Ų, N-methyl-N-(oxiran-2-ylmethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-N-(oxiran-2-ylmethyl)aniline has 0 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-methyl-N-(oxiran-2-ylmethyl)aniline?
The CAS number of N-methyl-N-(oxiran-2-ylmethyl)aniline is 14236-04-5.
What is the molecular formula of N-methyl-N-(oxiran-2-ylmethyl)aniline?
The molecular formula of N-methyl-N-(oxiran-2-ylmethyl)aniline is C10H13NO.
What is the molecular weight of N-methyl-N-(oxiran-2-ylmethyl)aniline?
The molecular weight of N-methyl-N-(oxiran-2-ylmethyl)aniline is 163.10 g/mol.
Where can I buy N-methyl-N-(oxiran-2-ylmethyl)aniline?
You can request a quote for N-methyl-N-(oxiran-2-ylmethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-N-(oxiran-2-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-N-(oxiran-2-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.