Basic information
- Standard SMILES
NCC(Cc1ccccc1)c1c[nH]c2ccccc12- InChIKey
BBCNPTHPRKICBG-UHFFFAOYSA-N- Molecular formula
- C17H18N2
- Average molar mass
- 250.34 g/mol
- Monoisotopic mass
- 250.14699858
Names & identifiers
- Preferred name
- 3-[(beta-Benzylamino)ethyl]indole
- IUPAC
- 2-(1H-indol-3-yl)-3-phenylpropan-1-amine
Names & synonyms
beta-Benzyltryptamine3-[(.beta.-Benzylamino)ethyl]indoleSCHEMBL2734102-(1H-Indol-3-yl)-3-phenyl-1-propanamine #
Database identifiers
- PubChem CID
- 582931
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 272
Related reactions
4 records
Compound notes
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