About 2-(1H-indol-5-ylmethoxy)ethanamine
2-(1H-indol-5-ylmethoxy)ethanamine (PubChem CID 154379316) has the molecular formula C11H14N2O
and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(1H-indol-5-ylmethoxy)ethanamine.
Molecular Properties
| Compound Name | 2-(1H-indol-5-ylmethoxy)ethanamine |
| PubChem CID | 154379316 |
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.25 g/mol |
| Exact Mass | 190.11 |
| IUPAC Name | 2-(1H-indol-5-ylmethoxy)ethanamine |
| SMILES | NCCOCc1ccc2[nH]ccc2c1 |
| InChI | InChI=1S/C11H14N2O/c12-4-6-14-8-9-1-2-11-10(7-9)3-5-13-11/h1-3,5,7,13H,4,6,8,12H2 |
| InChIKey | MWXGHSLSDGMCCC-UHFFFAOYSA-N |
| XLogP | 1.64 |
| TPSA | 51.04 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 190.25 |
| LogP ≤ 5 | 1.64 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
|---|
Analyze 2-(1H-indol-5-ylmethoxy)ethanamine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(1H-indol-5-ylmethoxy)ethanamine?
The IUPAC name of 2-(1H-indol-5-ylmethoxy)ethanamine (CID 154379316) is 2-(1H-indol-5-ylmethoxy)ethanamine.
What is the SMILES notation for 2-(1H-indol-5-ylmethoxy)ethanamine?
The canonical SMILES for 2-(1H-indol-5-ylmethoxy)ethanamine is NCCOCc1ccc2[nH]ccc2c1.
What is the InChIKey of 2-(1H-indol-5-ylmethoxy)ethanamine?
The InChIKey is MWXGHSLSDGMCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c12-4-6-14-8-9-1-2-11-10(7-9)3-5-13-11/h1-3,5,7,13H,4,6,8,12H2.
What are the key properties of 2-(1H-indol-5-ylmethoxy)ethanamine?
2-(1H-indol-5-ylmethoxy)ethanamine has a molecular weight of 190.25 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-5-ylmethoxy)ethanamine is sourced from PubChem (CID 154379316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).