Basic information
- CAS
20731-70-8- Standard SMILES
COc1ccc2[nH]cc(C(C)CN)c2c1- InChIKey
PLKJXFPRSHOODN-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- Indole, 3-(3-amino-2-propyl)-5-methoxy-
- IUPAC
- 2-(5-methoxy-1H-indol-3-yl)propan-1-amine
Names & synonyms
20731-70-8INDOLE, 3-(3-AMINO-2-PROPYL)-5-METHOXY-RefChem:10873342-(5-methoxy-1H-indol-3-yl)propan-1-amine5-Methoxy-beta-methyltryptamineCHEMBL149564BRN 04771845-22-12-00091 (Beilstein Handbook Reference)SCHEMBL9673757DTXSID50942946BDBM50068516AKOS022505994
Show more names
2-(5-Methoxy-1H-indol-3-yl)-propylamineCS-0275392EN300-6739696
Database identifiers
- CAS
20731-70-8- PubChem CID
- 30241
- DTXSID
DTXSID50942946- ChEMBL
CHEMBL149564
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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