Basic information
- Standard SMILES
COC(=O)c1csc(CN(C)C)c1- InChIKey
LTXDHLDEHBUVPH-UHFFFAOYSA-N- Molecular formula
- C9H13NO2S
- Average molar mass
- 199.27 g/mol
Names & identifiers
- Preferred name
- Methyl 5-(dimethylaminomethyl)-3-thiophenecarboxylate
- IUPAC
- methyl 5-[(dimethylamino)methyl]thiophene-3-carboxylate
Names & synonyms
SCHEMBL10673042LTXDHLDEHBUVPH-UHFFFAOYSA-NDB-158678Methyl 5-(dimethylaminomethyl)-3-thiophene carboxylatemethyl 5-(dimethylaminomethyl)-3-thiophenecarboxylateMethyl 5-[(dimethylamino)methyl]-3-thiophenecarboxylate78908-82-4
Database identifiers
- PubChem CID
- 12926495
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Related reactions
7 records
Compound notes
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