2-[3-(Trifluoromethyl)phenyl]tetrahydroimidazo[1,5-a]pyridine-1,3(2h,5h)-dione
Basic information
- CAS
60725-66-8- Standard SMILES
O=C1C2CCCCN2C(=O)N1c1cccc(C(F)(F)F)c1- InChIKey
OQCIXAXKXKFLGU-UHFFFAOYSA-N- Molecular formula
- C14H13F3N2O2
- Average molar mass
- 298.26 g/mol
- Monoisotopic mass
- 298.09291215
Names & identifiers
- Preferred name
- 2-[3-(Trifluoromethyl)phenyl]tetrahydroimidazo[1,5-a]pyridine-1,3(2h,5h)-dione
- IUPAC
- 2-[3-(trifluoromethyl)phenyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione
Names & synonyms
60725-66-82-[3-(trifluoromethyl)phenyl]tetrahydroimidazo[1,5-a]pyridine-1,3(2h,5h)-dioneDTXSID40976179AKOS009105352Imidazo(1,5-a)pyridine-1,3(2H,5H)-dione, tetrahydro-2-(3-(trifluoromethyl)phenyl)-
Database identifiers
- CAS
60725-66-8- PubChem CID
- 187983
- DTXSID
DTXSID40976179
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 452
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Compound notes
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