Basic information
- Standard SMILES
COC1CCC(N)c2ccsc21- InChIKey
QYYWVVUAOQWEEO-UHFFFAOYSA-N- Molecular formula
- C9H13NOS
- Average molar mass
- 183.27 g/mol
Names & identifiers
- Preferred name
- 4,5,6,7-Tetrahydro-7-methoxybenzo[b]thiophen-4-amine
- IUPAC
- 7-methoxy-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
Names & synonyms
SCHEMBL11825371QYYWVVUAOQWEEO-UHFFFAOYSA-N4,5,6,7-tetrahydro-7-methoxybenzo[b]thiophen-4-amine
Database identifiers
- PubChem CID
- 21490953
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Related reactions
4 records
Compound notes
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