2-[4-(Methylamino)butyl]isoindoline-1,3-dione

HCID 59838176
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Basic information

Standard SMILES
CNCCCCN1C(=O)c2ccccc2C1=O
InChIKey
UVQWXVGXLDVOQP-UHFFFAOYSA-N
Molecular formula
C13H16N2O2
Average molar mass
232.28 g/mol
Monoisotopic mass
232.12117776

Names & identifiers

Preferred name
2-[4-(Methylamino)butyl]isoindoline-1,3-dione
IUPAC
2-[4-(methylamino)butyl]isoindole-1,3-dione

Names & synonyms

2094975-92-3SCHEMBL2401234SCHEMBL31440045UVQWXVGXLDVOQP-UHFFFAOYSA-NDB-1923412-[4-(methylamino)butyl]isoindoline-1,3-dione2-[4-(Methylamino)butyl]-1h-isoindole-1,3(2h)-dione2-[4-(methylamino)butyl]-1H-isoindole-1.3(2H)-dione

Database identifiers

PubChem CID
59838176

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
49.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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