5-Phenoxy-1H-indole-3-ethanamine
Basic information
- CAS
31363-70-9- Standard SMILES
NCCc1c[nH]c2ccc(Oc3ccccc3)cc12- InChIKey
ZURXROHPCVOMGH-UHFFFAOYSA-N- Molecular formula
- C16H16N2O
- Average molar mass
- 252.31 g/mol
- Monoisotopic mass
- 252.12626314
Names & identifiers
- Preferred name
- 5-Phenoxy-1H-indole-3-ethanamine
- IUPAC
- 2-(5-phenoxy-1H-indol-3-yl)ethanamine
Names & synonyms
1H-INDOLE, 3-(2-AMINOETHYL)-5-PHENOXY-31363-70-9DTXSID40185284RefChem:1073217DTXCID501077755-Phenoxy-1H-indole-3-ethanamineCHEMBL52757783-(2-Aminoethyl)-5-phenoxyindole5-phenoxytryptamineSCHEMBL2540054SCHEMBL8800498ZURXROHPCVOMGH-UHFFFAOYSA-N
Show more names
BDBM506136642-(5-Phenoxy-1H-indol-3-yl)ethan-1-amine
Database identifiers
- CAS
31363-70-9- PubChem CID
- 35780
- DTXSID
DTXSID40185284- ChEMBL
CHEMBL5275778
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 278
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Related reactions
3 records
Compound notes
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