Basic information
- Standard SMILES
CCC1(CCCCl)C(=O)Nc2ccccc21- InChIKey
LOEWQKRBLZPRCW-UHFFFAOYSA-N- Molecular formula
- C13H16ClNO
- Average molar mass
- 237.72 g/mol
Names & identifiers
- Preferred name
- 3-(3-Chloropropyl)-3-ethyl-1,3-dihydro-2H-indol-2-one
- IUPAC
- 3-(3-chloropropyl)-3-ethyl-1H-indol-2-one
Names & synonyms
SCHEMBL2981198LOEWQKRBLZPRCW-UHFFFAOYSA-N3-(3-Chloropropyl)-3-ethyl-1,3-dihydro-2H-indol-2-one
Database identifiers
- PubChem CID
- 68465271
- Nikkaji
- J3.673.365I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 269
Related reactions
4 records
Compound notes
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