Basic information
- Standard SMILES
CC(NC(=O)C1(O)CCC(NC(=O)OC(C)(C)C)CC1)c1ccccc1- InChIKey
YLEAYGYGUAUGMR-UHFFFAOYSA-N- Molecular formula
- C20H30N2O4
- Average molar mass
- 362.5 g/mol
Names & identifiers
- Preferred name
- [4-Hydroxy-4-(1-phenyl-ethylcarbamoyl)-cyclohexyl]-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[4-hydroxy-4-(1-phenylethylcarbamoyl)cyclohexyl]carbamate
Names & synonyms
SCHEMBL1954027YLEAYGYGUAUGMR-UHFFFAOYSA-NDB-173817Tert-butyl 4-(1-phenylethylcarbamoyl)-4-hydroxycyclohexylcarbamate[4-hydroxy-4-(1-phenyl-ethylcarbamoyl)-cyclohexyl]-carbamic acid tert-butyl ester1310478-98-8
Database identifiers
- PubChem CID
- 58292016
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 487
Related reactions
2 records
Compound notes
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