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Basic information
- CAS
14845-01-3- Standard SMILES
CC1c2ccccc2N(CCc2ccncc2)C1C- InChIKey
KLWAURRNVDIGJR-UHFFFAOYSA-N- Molecular formula
- C17H20N2
- Average molar mass
- 252.35 g/mol
- Monoisotopic mass
- 252.16264865
Names & identifiers
- Preferred name
- 2,3-Dimethyl-1-(2-(4-pyridyl)ethyl)indoline
- IUPAC
- 2,3-dimethyl-1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
Names & synonyms
14845-01-3BRN 04040972,3-Dimethyl-1-(2-(4-pyridyl)ethyl)indolineIndoline, 2,3-dimethyl-1-(2-(4-pyridyl)ethyl)-1-beta-(Pyridyl-4')-ethyl-2,3-dimethyl-2,3-dihydroindoleDTXSID909334142,3-Dimethyl-1-[2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indole
Database identifiers
- CAS
14845-01-3- PubChem CID
- 203641
- DTXSID
DTXSID90933414
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 16.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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