Basic information
- CAS
42062-39-5- Standard SMILES
CN(C)CC(O)c1cn(C)c2ccccc12- InChIKey
USFMLOCAUMOVRI-UHFFFAOYSA-N- Molecular formula
- C13H18N2O
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.1419132
Names & identifiers
- Preferred name
- Indole-3-methanol, alpha-((dimethylamino)methyl)-1-methyl-
- IUPAC
- 2-(dimethylamino)-1-(1-methylindol-3-yl)ethanol
Names & synonyms
42062-39-5INDOLE-3-METHANOL, alpha-((DIMETHYLAMINO)METHYL)-1-METHYL-RefChem:1087362alpha-((Dimethylamino)methyl)-1-methylindole-3-methanolNSC 27393BRN 0175548U-5092NSC27393DTXSID001384316NSC-273932-(dimethylamino)-1-(1-methyl-1H-indol-3-yl)ethanol
Database identifiers
- CAS
42062-39-5- PubChem CID
- 39131
- DTXSID
DTXSID001384316
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 28.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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