Basic information
- Standard SMILES
CN1CCCC1CCNCc1cc2ccccc2s1- InChIKey
KSRNVODFKDISBN-UHFFFAOYSA-N- Molecular formula
- C16H22N2S
- Average molar mass
- 274.4 g/mol
Names & identifiers
- Preferred name
- Benzo[b]thiophen-2-ylmethyl-[2-(1-methyl-pyrrolidin-2-yl)-ethyl]-amine
- IUPAC
- N-(1-benzothiophen-2-ylmethyl)-2-(1-methylpyrrolidin-2-yl)ethanamine
Names & synonyms
SCHEMBL3506380KSRNVODFKDISBN-UHFFFAOYSA-NBenzo[b]thiophen-2-ylmethyl-[2-(1-methyl-pyrrolidin-2-yl)-ethyl]-amine
Database identifiers
- PubChem CID
- 59773016
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 43.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Related reactions
2 records
Linked notes
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