N,N'-bis(3,4-dicyanophenyl)pentanediamide
Basic information
- CAS
57414-36-5- Standard SMILES
N#Cc1ccc(NC(=O)CCCC(=O)Nc2ccc(C#N)c(C#N)c2)cc1C#N- InChIKey
JPPCDCMCPFHBEY-UHFFFAOYSA-N- Molecular formula
- C21H14N6O2
- Average molar mass
- 382.4 g/mol
- Monoisotopic mass
- 382.11782371
Names & identifiers
- Preferred name
- N,N'-bis(3,4-dicyanophenyl)pentanediamide
- IUPAC
- N,N'-bis(3,4-dicyanophenyl)pentanediamide
Names & synonyms
NSC309816NSC-309816
Database identifiers
- CAS
57414-36-5- PubChem CID
- 328879
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 747
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Compound notes
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