Basic information
- CAS
63938-58-9- Standard SMILES
CC(C)C[NH2+]CCc1c[nH]c2ccccc12.[Cl-]- InChIKey
LMAWWLWEYRLMSD-UHFFFAOYSA-N- Molecular formula
- C14H21ClN2
- Average molar mass
- 252.78 g/mol
- Monoisotopic mass
- 252.1393264
Names & identifiers
- Preferred name
- Indole, 3-(2-(2-isobutylamino)ethyl)-, monohydrochloride
- IUPAC
- 2-(1H-indol-3-yl)ethyl-(2-methylpropyl)azanium chloride
Names & synonyms
INDOLE, 3-(2-(2-ISOBUTYLAMINO)ETHYL)-, MONOHYDROCHLORIDE63938-58-9RefChem:10873183-(2-(2-Isobutylamino)ethyl)indole monohydrochloride
Database identifiers
- CAS
63938-58-9- PubChem CID
- 45585
Properties
Computed structural properties
- Topological polar surface area
- 32.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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