2-[2-(5-Ethylpyridin-2-yl)ethyl]-1h-isoindole-1,3(2h)-dione
Basic information
- CAS
17624-24-7- Standard SMILES
CCc1ccc(CCN2C(=O)c3ccccc3C2=O)nc1- InChIKey
QFAXLQGMGSJABE-UHFFFAOYSA-N- Molecular formula
- C17H16N2O2
- Average molar mass
- 280.32 g/mol
- Monoisotopic mass
- 280.12117776
Names & identifiers
- Preferred name
- 2-[2-(5-Ethylpyridin-2-yl)ethyl]-1h-isoindole-1,3(2h)-dione
- IUPAC
- 2-[2-(5-ethyl-2-pyridinyl)ethyl]isoindole-1,3-dione
Names & synonyms
MLS00073800417624-24-72-[2-(5-ethylpyridin-2-yl)ethyl]-1h-isoindole-1,3(2h)-dioneNSC22801CHEMBL1727712DTXSID40281735HMS2754H18NSC-22801SMR000393682
Database identifiers
- CAS
17624-24-7- PubChem CID
- 229284
- DTXSID
DTXSID40281735- ChEMBL
CHEMBL1727712
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 50.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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