Basic information
- Standard SMILES
O=C1C(Cc2cc3ccccc3s2)CCN1C1CCCCC1- InChIKey
DTSGHZSGQCMCCI-UHFFFAOYSA-N- Molecular formula
- C19H23NOS
- Average molar mass
- 313.5 g/mol
Names & identifiers
- Preferred name
- 3-Benzo[b]thiophen-2-ylmethyl-1-cyclohexyl-pyrrolidin-2-one
- IUPAC
- 3-(1-benzothiophen-2-ylmethyl)-1-cyclohexylpyrrolidin-2-one
Names & synonyms
SCHEMBL3744360DTSGHZSGQCMCCI-UHFFFAOYSA-N3-Benzo[b]thiophen-2-ylmethyl-1-cyclohexyl-pyrrolidin-2-one
Database identifiers
- PubChem CID
- 11645326
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 48.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 406
Related reactions
2 records
Compound notes
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