N-[4-(1H-imidazol-1-yl)-2-butenyl]isoindole-1,3-(2H)-dione

HCID 54070864
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Basic information

Standard SMILES
O=C1c2ccccc2C(=O)N1CC=CCn1ccnc1
InChIKey
MGIJYCYSMNTIMC-UHFFFAOYSA-N
Molecular formula
C15H13N3O2
Average molar mass
267.28 g/mol
Monoisotopic mass
267.10077667

Names & identifiers

Preferred name
N-[4-(1H-imidazol-1-yl)-2-butenyl]isoindole-1,3-(2H)-dione
IUPAC
2-(4-imidazol-1-ylbut-2-enyl)isoindole-1,3-dione

Names & synonyms

SCHEMBL10857713MGIJYCYSMNTIMC-UHFFFAOYSA-NN-[4-(1H-imidazol-1-yl)-2-butenyl]isoindole-1,3-(2H)-dione

Database identifiers

PubChem CID
54070864

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
55.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
20

Related reactions

2 records
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Compound notes

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