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Basic information
- Standard SMILES
Cc1ccncc1N1CCN(c2ccc(C#N)cc2)C1=O- InChIKey
IXZUCLBXKNHBBC-UHFFFAOYSA-N- Molecular formula
- C16H14N4O
- Average molar mass
- 278.31 g/mol
- Monoisotopic mass
- 278.11676108
Names & identifiers
- Preferred name
- 4-[3-(4-Methyl-pyridin-3-yl)-2-oxo-imidazolidin-1-yl)-benzonitrile
- IUPAC
- 4-[3-(4-methyl-3-pyridinyl)-2-oxoimidazolidin-1-yl]benzonitrile
Names & synonyms
4-[3-(4-Methyl-pyridin-3-yl)-2-oxo-imidazolidin-1-yl)-benzonitrile4-[3-(4-Methyl-pyridin-3-yl)-2-oxo-imidazolidin-1-yl]-benzonitrileSCHEMBL3782066IXZUCLBXKNHBBC-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 59636259
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 435
Related reactions
2 records
Compound notes
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