Basic information
- Standard SMILES
CC(C)N(C(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)C(C)C- InChIKey
QROQIWWEMXYLPO-UHFFFAOYSA-N- Molecular formula
- C21H24N2O2
- Average molar mass
- 336.4 g/mol
Names & identifiers
- Preferred name
- N,N-bis(isopropyl)-2 [[4'-cyano-(1,1'-biphenyl)-4-yl]oxy]-acetamide
- IUPAC
- 2-[4-(4-cyanophenyl)phenoxy]-N,N-di(propan-2-yl)acetamide
Names & synonyms
SCHEMBL8082813QROQIWWEMXYLPO-UHFFFAOYSA-NN,N-bis(isopropyl)-2 [[4'-cyano-(1,1'-biphenyl)-4-yl]oxy]-acetamideN,N-bis(isopropyl)-2[[4'-cyano-(1,1'-biphenyl)-4-yl]oxy]-acetamide
Database identifiers
- PubChem CID
- 7670475
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 456
Related reactions
2 records
Compound notes
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