4-Quinolinecarboxamide, 2-(dicyanomethyl)-N,N-diethyl-
Basic information
- CAS
194713-16-1- Standard SMILES
CCN(CC)C(=O)c1cc(C(C#N)C#N)nc2ccccc12- InChIKey
XKEXSNWLUPJZKT-UHFFFAOYSA-N- Molecular formula
- C17H16N4O
- Average molar mass
- 292.33 g/mol
- Monoisotopic mass
- 292.13241115
Names & identifiers
- Preferred name
- 4-Quinolinecarboxamide, 2-(dicyanomethyl)-N,N-diethyl-
- IUPAC
- 2-(dicyanomethyl)-N,N-diethylquinoline-4-carboxamide
Names & synonyms
4-Quinolinecarboxamide, 2-(dicyanomethyl)-N,N-diethyl-2-(Dicyanomethyl)-N,N-diethyl-4-quinolinecarboxamide194713-16-1DTXSID10173113RefChem:296258DTXCID70956042-(dicyanomethyl)-N,N-diethylquinoline-4-carboxamide
Database identifiers
- CAS
194713-16-1- PubChem CID
- 3075652
- DTXSID
DTXSID10173113
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 479
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Compound notes
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