Phthalimide, N-(4-(octahydroazocin-1-yl)but-2-ynyl)-
Basic information
- CAS
19446-30-1- Standard SMILES
O=C1c2ccccc2C(=O)N1CC#CCN1CCCCCCC1- InChIKey
YLXJAIWUVMTROU-UHFFFAOYSA-N- Molecular formula
- C19H22N2O2
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.16812795
Names & identifiers
- Preferred name
- Phthalimide, N-(4-(octahydroazocin-1-yl)but-2-ynyl)-
- IUPAC
- 2-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione
- English name
- 2-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione
- Molecular formula
- C19H22N2O2
- Molecular weight
- 0
Names & synonyms
Phthalimide, N-(4-(octahydroazocin-1-yl)but-2-ynyl)-19446-30-1BRN 5756676N-(4-(Octahydroazocin-1-yl)but-2-ynyl)phthalimideDTXSID50173076RefChem:371588DTXCID30955672-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione2-[4-(azocan-1-yl)but-2-yn-1-yl]-1h-isoindole-1,3(2h)-dioneSCHEMBL29549485ZM-IN-[4-(Octahydroazocin-1-yl)-2-butynyl]phthalimide
Database identifiers
- CAS
19446-30-1- PubChem CID
- 209205
- DTXSID
DTXSID50173076- Nikkaji
- J107.161K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 484
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Related reactions
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Compound notes
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