Basic information
- Standard SMILES
CNCc1ccc2sccc2c1- InChIKey
GSHXSOAGSVYMIH-UHFFFAOYSA-N- Molecular formula
- C10H11NS
- Average molar mass
- 177.27 g/mol
- Monoisotopic mass
- 177.06122035
Names & identifiers
- Preferred name
- Benzo[b]thiophene-5-methanamine, N-methyl-
- IUPAC
- 1-(1-benzothiophen-5-yl)-N-methylmethanamine
Names & synonyms
934993-63-2Benzo[b]thiophene-5-methanamine, N-methyl-1-(Benzo[b]thiophen-5-yl)-N-methylmethanamineSCHEMBL1254388GSHXSOAGSVYMIH-UHFFFAOYSA-NDTXSID901278984(1-benzothien-5-ylmethyl)methylamineAKOS003237292N-Methylbenzo[b]thiophene-5-methanaminebenzo[b]thiophen-5-yl-N-methylmethanamineDB-0886421-(1-benzothiophen-5-yl)-N-methylmethanamine
Database identifiers
- CAS
934993-63-2- PubChem CID
- 16640607
- DTXSID
DTXSID901278984
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 40.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Related reactions
6 records
Linked notes
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