Basic information
- Standard SMILES
Cc1c(C(C)N)sc2ccccc12- InChIKey
UXKMJXGBXBAIJA-UHFFFAOYSA-N- Molecular formula
- C11H13NS
- Average molar mass
- 191.29 g/mol
Names & identifiers
- Preferred name
- 1-(3-Methyl-1-benzothiophen-2-yl)ethan-1-amine
- IUPAC
- 1-(3-methyl-1-benzothiophen-2-yl)ethanamine
Names & synonyms
1-(3-methyl-1-benzothiophen-2-yl)ethan-1-amine159009-28-6SCHEMBL4093915AKOS009159090EN300-58164AB00999659-01
Database identifiers
- PubChem CID
- 18965409
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Related reactions
1 records
Compound notes
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