Basic information
- CAS
101832-78-4- Standard SMILES
CC(C)C(N)Cc1cn(C)c2ccccc12- InChIKey
PDWLVTSRLBTGBC-UHFFFAOYSA-N- Molecular formula
- C14H20N2
- Average molar mass
- 216.32 g/mol
- Monoisotopic mass
- 216.16264865
Names & identifiers
- Preferred name
- Indole, 3-(2-amino-3-methylbutyl)-1-methyl-
- IUPAC
- 3-methyl-1-(1-methylindol-3-yl)butan-2-amine
Names & synonyms
INDOLE, 3-(2-AMINO-3-METHYLBUTYL)-1-METHYL-101832-78-4RefChem:1087327BRN 03943731-Methyl-3-(alpha-isopropylaminoethyl)indole3-(2-Amino-3-methylbutyl)-1-methylindole5-22-10-00196 (Beilstein Handbook Reference)DTXSID609067163-Methyl-1-(1-methyl-1H-indol-3-yl)butan-2-amine
Database identifiers
- CAS
101832-78-4- PubChem CID
- 59008
- DTXSID
DTXSID60906716
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 31 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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