1-Methoxy-3-(aminomethyl)indole
PubChem CID: 11332792
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| Compound Synonyms | 1-methoxy-3-(aminomethyl)indole, (1-methoxyindol-3-yl)methanamine, 1-MeO-I3CH2NH2, 1-methoxyindole-3-methanamine, 1-methoxyindole-3-methylamine, 1-methoxyindole-3-ylmethylamine, CHEBI:91161, (1-methoxyindol-3-yl)methylamine, 1-(1-methoxy-1H-indol-3-yl)methanamine, Q27163097 |
|---|---|
| Topological Polar Surface Area | 40.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 174.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (1-methoxyindol-3-yl)methanamine |
| Nih Violation | False |
| Prediction Hob | 0.0 |
| Xlogp | 1.3 |
| Is Pains | False |
| Molecular Formula | C10H12N2O |
| Prediction Swissadme | 0.0 |
| Inchi Key | GAHLHXRCZDVQSW-UHFFFAOYSA-N |
| Fcsp3 | 0.2 |
| Rotatable Bond Count | 2.0 |
| Compound Name | 1-Methoxy-3-(aminomethyl)indole |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 176.095 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 176.095 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 176.21 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.106665492307692 |
| Inchi | InChI=1S/C10H12N2O/c1-13-12-7-8(6-11)9-4-2-3-5-10(9)12/h2-5,7H,6,11H2,1H3 |
| Smiles | CON1C=C(C2=CC=CC=C21)CN |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Arabidopsis Thaliana (Plant) Rel Props:Source_db:cmaup_ingredients