3-(1,3-Diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-yl)piperidin-2-one
Basic information
- CAS
59324-30-0- Standard SMILES
O=C1NCCCC1c1nc2cccc3c2n1CCC3- InChIKey
FGJZMZNULKHRHO-UHFFFAOYSA-N- Molecular formula
- C15H17N3O
- Average molar mass
- 255.31 g/mol
- Monoisotopic mass
- 255.13716217
Names & identifiers
- Preferred name
- 3-(1,3-Diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-yl)piperidin-2-one
- IUPAC
- 3-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-yl)piperidin-2-one
Names & synonyms
NSC23199359324-30-0DTXSID30310821NSC-2319933-(5,6-Dihydro-4H-imidazo[4,5,1-ij]quinolin-2-yl)piperidin-2-one
Database identifiers
- CAS
59324-30-0- PubChem CID
- 314504
- DTXSID
DTXSID30310821
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 372
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Compound notes
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