Basic information
- Standard SMILES
CC(C)N(CCC(C#N)c1ccc(-c2ccccc2)cc1)C(C)C- InChIKey
HFZWZBJJPJQAEZ-UHFFFAOYSA-N- Molecular formula
- C22H28N2
- Average molar mass
- 320.5 g/mol
Names & identifiers
- Preferred name
- alpha-(4-Biphenylyl)-alpha-[2-(diisopropylamino)ethyl]acetonitrile
- IUPAC
- 4-[di(propan-2-yl)amino]-2-(4-phenylphenyl)butanenitrile
Names & synonyms
alpha-(4-biphenylyl)-alpha-[2-(diisopropylamino)ethyl]acetonitrilealpha-[4-biphenylyl)-alpha-[2-(diisopropylamino)ethyl]acetonitrileSCHEMBL10516402HFZWZBJJPJQAEZ-UHFFFAOYSA-N2-(4-phenylphenyl)-4-[N,N-bis(1-methylethyl)amino]butanenitrile
Database identifiers
- PubChem CID
- 14569341
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 383
Related reactions
10 records
Compound notes
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