Basic information
- Standard SMILES
COC1=NCCCC1N1C(=O)c2ccccc2C1=O- InChIKey
OTXVUBDRWCOITC-UHFFFAOYSA-N- Molecular formula
- C14H14N2O3
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.10044231
Names & identifiers
- Preferred name
- (+/-)2-(2-methoxy-3,4,5,6-tetrahydropyridin-3-yl)-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-(6-methoxy-2,3,4,5-tetrahydropyridin-5-yl)isoindole-1,3-dione
Names & synonyms
SCHEMBL2065328OTXVUBDRWCOITC-UHFFFAOYSA-N(+/-) 2-(2-Methoxy-3,4,5,6-tetrahydropyridin-3-yl)-1H-isoindole-1,3(2H)-dione(+/-)-2-(2-Methoxy-3,4,5,6-tetrahydropyridin-3-yl)-1H-isoindole-1,3(2H)-dione(+/-)2-(2-methoxy-3,4,5,6-tetrahydropyridin-3-yl)-1H-isoindole-1,3(2H)-dione
Database identifiers
- PubChem CID
- 67265802
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 408
Related reactions
5 records
Compound notes
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