Basic information
- Standard SMILES
COc1ccc2[nH]c(C)c(C(C)=O)c2c1- InChIKey
PLKHPGZPVMZOQI-UHFFFAOYSA-N- Molecular formula
- C12H13NO2
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.09462866
Names & identifiers
- Preferred name
- 1-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanone
- IUPAC
- 1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Names & synonyms
1-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanone55895-80-21-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-oneCBDivE_010506Cambridge id 5255624SCHEMBL7344801FCA89580AKOS0041185031-(5-methoxy-2-methyl-lH-indol-3-yl)ethanoneEN300-15560361-(5-methoxy-2-methyl-1H-indol-3- yl)ethanoneSR-01000441882
Show more names
1-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanone #Ethanone, 1-(5-methoxy-2-methyl-3(1H)-indolyl)-SR-01000441882-1
Database identifiers
- PubChem CID
- 604823
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 42.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 254
Related reactions
4 records
Compound notes
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