F5X
2-(6-methoxy-1H-indol-3-yl)ethanamine
Created: | 2020-04-01 |
Last modified: | 2021-03-01 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 28 |
Chiral Atom Count | 0 |
Bond Count | 29 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
---|---|
Name | 2-(6-methoxy-1H-indol-3-yl)ethanamine |
Synonyms | 6-Methoxytryptamine |
Systematic Name (OpenEye OEToolkits) | 2-(6-methoxy-1~{H}-indol-3-yl)ethanamine |
Formula | C11 H14 N2 O |
Molecular Weight | 190.242 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1ccc2c(CCN)c[nH]c2c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)[nH]cc2CCN |
Canonical SMILES | CACTVS | 3.385 | COc1ccc2c(CCN)c[nH]c2c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)[nH]cc2CCN |
InChI | InChI | 1.03 | InChI=1S/C11H14N2O/c1-14-9-2-3-10-8(4-5-12)7-13-11(10)6-9/h2-3,6-7,13H,4-5,12H2,1H3 |
InChIKey | InChI | 1.03 | VOCGEKMEZOPDFP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 17654 |
ChEMBL | CHEMBL337825 |