3-(Morpholinomethyl)indole
TL;DR: 3-(Morpholinomethyl)indole (CAS 5379-88-4) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1H-indol-3-ylmethyl)morpholine
Also Known As: 3-(Morpholinomethyl)indole, 3-MORPHOLIN-4-YLMETHYL-1H-INDOLE, 4-(1H-indol-3-ylmethyl)morpholine, 3-Morpholinomethyl-indol, INDOLE, 3-(MORPHOLINOMETHYL)-
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 28.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
| Solubility | >32.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 5379-88-4 |
|---|---|
| SMILES | C1COCCN1CC2=CNC3=CC=CC=C32 |
| InChIKey | VHGISLOQNDQFIW-UHFFFAOYSA-N |
Product Overview
3-(Morpholinomethyl)indole (CAS 5379-88-4), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: 4-(1H-indol-3-ylmethyl)morpholine.
Chemical Property Profile of 3-(Morpholinomethyl)indole
Property Insights of 3-(Morpholinomethyl)indole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Morpholinomethyl)indole. With a topological polar surface area (TPSA) of 28.3 Ų, 3-(Morpholinomethyl)indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Morpholinomethyl)indole 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 3-(Morpholinomethyl)indole?
The CAS number of 3-(Morpholinomethyl)indole is 5379-88-4.
What is the molecular formula of 3-(Morpholinomethyl)indole?
The molecular formula of 3-(Morpholinomethyl)indole is C13H16N2O.
What is the molecular weight of 3-(Morpholinomethyl)indole?
The molecular weight of 3-(Morpholinomethyl)indole is 216.13 g/mol.
Where can I buy 3-(Morpholinomethyl)indole?
You can request a quote for 3-(Morpholinomethyl)indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Morpholinomethyl)indole?
Yes, KEHONG BIO provides custom synthesis services for 3-(Morpholinomethyl)indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.