Basic information
- Standard SMILES
Cc1sc2cc(O)ccc2c1C(=O)NCC1CC1- InChIKey
CEZMCDJBPRAWFT-UHFFFAOYSA-N- Molecular formula
- C14H15NO2S
- Average molar mass
- 261.34 g/mol
- Monoisotopic mass
- 261.08234989
Names & identifiers
- Preferred name
- 6-Hydroxy-2-methylbenzo[b]thiophene-3-carboxylic acid (cyclopropylmethyl)amide
- IUPAC
- N-(cyclopropylmethyl)-6-hydroxy-2-methyl-1-benzothiophene-3-carboxamide
Names & synonyms
SCHEMBL14409856CEZMCDJBPRAWFT-UHFFFAOYSA-N6-hydroxy-2-methylbenzo[b]thiophene-3-carboxylic acid (cyclopropylmethyl)amide
Database identifiers
- PubChem CID
- 20767922
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 332
Related reactions
5 records
Compound notes
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