Basic information
- CAS
76103-68-9- Standard SMILES
CN1CCCC1CC(=O)c1cccs1- InChIKey
HBZZDRWGYYYGLY-UHFFFAOYSA-N- Molecular formula
- C11H15NOS
- Average molar mass
- 209.31 g/mol
- Monoisotopic mass
- 209.08743528
Names & identifiers
- Preferred name
- Ethanone, 2-(1-methyl-2-pyrrolidinyl)-1-(2-thienyl)-
- IUPAC
- 2-(1-methylpyrrolidin-2-yl)-1-thiophen-2-ylethanone
Names & synonyms
76103-68-9ETHANONE, 2-(1-METHYL-2-PYRROLIDINYL)-1-(2-THIENYL)-RefChem:1084586BRN 60567532-(1-Methyl-2-pyrrolidinyl)-1-(2-thienyl)ethanoneDTXSID609974672-(1-Methylpyrrolidin-2-yl)-1-(thiophen-2-yl)ethan-1-one
Database identifiers
- CAS
76103-68-9- PubChem CID
- 53440
- DTXSID
DTXSID60997467
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 48.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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