Basic information
- CAS
55852-54-5- Standard SMILES
CCCc1ccc2[nH]cc(CCN)c2c1- InChIKey
FKFXKCOMJSHBBC-UHFFFAOYSA-N- Molecular formula
- C13H18N2
- Average molar mass
- 202.3 g/mol
- Monoisotopic mass
- 202.14699858
Names & identifiers
- Preferred name
- 5-Propyltryptamine
- IUPAC
- 2-(5-propyl-1H-indol-3-yl)ethanamine
Names & synonyms
5-Propyltryptamine1H-Indole-3-ethanamine, 5-propyl-55852-54-52-(5-propyl-1H-indol-3-yl)ethan-1-amineOprea1_864329SCHEMBL1913860DTXSID50204450AKOS037623333EU-0078614
Database identifiers
- CAS
55852-54-5- PubChem CID
- 699098
- DTXSID
DTXSID50204450- Nikkaji
- J2.873.203A
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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