Basic information
- CAS
61859-29-8- Standard SMILES
O=C(C=Cc1cccs1)N1CCCCC1- InChIKey
ZGYJRCNUWVKODW-UHFFFAOYSA-N- Molecular formula
- C12H15NOS
- Average molar mass
- 221.32 g/mol
- Monoisotopic mass
- 221.08743528
Names & identifiers
- Preferred name
- Piperidine, 1-[1-oxo-3-(2-thienyl)-2-propenyl]-
- IUPAC
- 1-piperidin-1-yl-3-thiophen-2-ylprop-2-en-1-one
Names & synonyms
61859-29-8Piperidine, 1-[1-oxo-3-(2-thienyl)-2-propenyl]-DTXSID70358449AKOS0341597711-(piperidin-1-yl)-3-(thiophen-2-yl)prop-2-en-1-one
Database identifiers
- CAS
61859-29-8- PubChem CID
- 896100
- DTXSID
DTXSID70358449
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 48.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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