1-(1-Butyl-1H-indol-3-yl)-2-(dimethylamino)ethan-1-ol
Basic information
- CAS
108980-93-4- Standard SMILES
CCCCn1cc(C(O)CN(C)C)c2ccccc21- InChIKey
HTKVTIBNRKCQHT-UHFFFAOYSA-N- Molecular formula
- C16H24N2O
- Average molar mass
- 260.37 g/mol
- Monoisotopic mass
- 260.18886339
Names & identifiers
- Preferred name
- 1-(1-Butyl-1H-indol-3-yl)-2-(dimethylamino)ethan-1-ol
- IUPAC
- 1-(1-butylindol-3-yl)-2-(dimethylamino)ethanol
Names & synonyms
108980-93-4DTXSID709109451-(1-Butyl-1H-indol-3-yl)-2-(dimethylamino)ethan-1-olRefChem:1053733DTXCID401339987BRN 04067881-Butyl-alpha-((dimethylamino)methyl)indole-3-methanolINDOLE-3-METHANOL, 1-BUTYL-alpha-((DIMETHYLAMINO)METHYL)-
Database identifiers
- CAS
108980-93-4- PubChem CID
- 60284
- DTXSID
DTXSID70910945
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 28.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 269
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Compound notes
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