Basic information
- CAS
55654-91-6- Standard SMILES
Cn1cc(C(O)CNCc2ccccc2)c2ccccc21- InChIKey
LUVRZHFKFRDWDK-UHFFFAOYSA-N- Molecular formula
- C18H20N2O
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.15756327
Names & identifiers
- Preferred name
- 2-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-ol
- IUPAC
- 2-(benzylamino)-1-(1-methylindol-3-yl)ethanol
Names & synonyms
55654-91-6DTXSID409710082-(Benzylamino)-1-(1-methyl-1H-indol-3-yl)ethan-1-olRefChem:1061463DTXCID601398529alpha-((Benzylamino)methyl)-1-methylindole-3-methanolBRN 0260681INDOLE-3-METHANOL, alpha-((BENZYLAMINO)METHYL)-1-METHYL-1H-Indole-3-methanol, 1-methyl-alpha-(((phenylmethyl)amino)methyl)-5-22-12-00078 (Beilstein Handbook Reference)
Database identifiers
- CAS
55654-91-6- PubChem CID
- 41503
- DTXSID
DTXSID40971008
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 37.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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