N-(furan-2-ylmethyl)-2-methylaniline
TL;DR: N-(furan-2-ylmethyl)-2-methylaniline (CAS 53656-10-3) is a chemical compound with molecular formula C12H13NO and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-methylaniline
Also Known As: N-(O-Tolyl)furfurylamine, N-Furfuryl-2-methylaniline, Furan-2-ylmethyl-o-tolyl-amine, N-(furan-2-ylmethyl)-2-methylaniline, N-[(furan-2-yl)methyl]-2-methylaniline
| Molecular Formula | C12H13NO |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 25.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.09972 |
| Heavy Atoms | 14 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 53656-10-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NCC2=CC=CO2 |
| InChIKey | GVAFADHNSYZXOJ-UHFFFAOYSA-N |
Product Overview
N-(furan-2-ylmethyl)-2-methylaniline (CAS 53656-10-3), with molecular formula C12H13NO and molecular weight 187.10 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-methylaniline.
Chemical Property Profile of N-(furan-2-ylmethyl)-2-methylaniline
Property Insights of N-(furan-2-ylmethyl)-2-methylaniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(furan-2-ylmethyl)-2-methylaniline. With a topological polar surface area (TPSA) of 25.2 Ų, N-(furan-2-ylmethyl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(furan-2-ylmethyl)-2-methylaniline 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-(furan-2-ylmethyl)-2-methylaniline?
The CAS number of N-(furan-2-ylmethyl)-2-methylaniline is 53656-10-3.
What is the molecular formula of N-(furan-2-ylmethyl)-2-methylaniline?
The molecular formula of N-(furan-2-ylmethyl)-2-methylaniline is C12H13NO.
What is the molecular weight of N-(furan-2-ylmethyl)-2-methylaniline?
The molecular weight of N-(furan-2-ylmethyl)-2-methylaniline is 187.10 g/mol.
Where can I buy N-(furan-2-ylmethyl)-2-methylaniline?
You can request a quote for N-(furan-2-ylmethyl)-2-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(furan-2-ylmethyl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-ylmethyl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.