Basic information
- Standard SMILES
CCCCC(=O)N(Cc1ccc(-c2ccccc2C#N)cc1)C1(C(=O)OCc2ccccc2)CCCC1- InChIKey
CJAULBUQYAEXBT-UHFFFAOYSA-N- Molecular formula
- C32H34N2O3
- Average molar mass
- 494.6 g/mol
Names & identifiers
- Preferred name
- N-(1-benzyloxycarbonylcyclopentyl)-N-(2'-cyanobiphenyl-4-ylmethyl)-N-pentanoyl-amine
- IUPAC
- benzyl 1-[[4-(2-cyanophenyl)phenyl]methyl-pentanoylamino]cyclopentane-1-carboxylate
Names & synonyms
SCHEMBL3575CJAULBUQYAEXBT-UHFFFAOYSA-NN-(1-benzyloxycarbonylcyclopentyl)-N-(2'-cyanobiphenyl-4-ylmethyl)-N-pentanoyl-amine
Database identifiers
- PubChem CID
- 20083535
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 781
Related reactions
3 records
Compound notes
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