Naepaine
TL;DR: Naepaine (CAS 2188-67-2) is a chemical compound with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pentylamino)ethyl 4-aminobenzoate
Also Known As: Naepaine, Amylsine, Amalcaine, Amylcaine, Amylcain
| Molecular Formula | C14H22N2O2 |
|---|---|
| Molecular Weight | 250.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 250.16812 |
| Heavy Atoms | 18 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 2188-67-2 |
|---|---|
| SMILES | CCCCCNCCOC(=O)C1=CC=C(C=C1)N |
| InChIKey | UYXHCVFXDBNRQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naepaine (CAS 2188-67-2), with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol. IUPAC: 2-(pentylamino)ethyl 4-aminobenzoate.
Chemical Property Profile of Naepaine
Property Insights of Naepaine
The XLogP value of 3.1 indicates that Naepaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Naepaine. Following Lipinski's Rule of Five, Naepaine has 2 hydrogen bond donor(s) and 4 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 Naepaine?
The CAS number of Naepaine is 2188-67-2.
What is the molecular formula of Naepaine?
The molecular formula of Naepaine is C14H22N2O2.
What is the molecular weight of Naepaine?
The molecular weight of Naepaine is 250.17 g/mol.
Where can I buy Naepaine?
You can request a quote for Naepaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naepaine?
Yes, KEHONG BIO provides custom synthesis services for Naepaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.