Basic information
- Standard SMILES
CC(=O)NCCC(NC(=O)OC(C)(C)C)c1ccc(Cl)cc1- InChIKey
GRAJQGPJCDLZMV-UHFFFAOYSA-N- Molecular formula
- C16H23ClN2O3
- Average molar mass
- 326.82 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 3-acetamido-1-(4-chlorophenyl)propylcarbamate
- IUPAC
- tert-butyl N-[3-acetamido-1-(4-chlorophenyl)propyl]carbamate
Names & synonyms
SCHEMBL390470GRAJQGPJCDLZMV-UHFFFAOYSA-NDB-159417tert-butyl 3-acetamido-1-(4-chlorophenyl)propylcarbamateN-[3-(acetylamino)-1-(4-chlorophenyl)propyl]carbamic acid 1,1-dimethylethyl ester1143534-19-3
Database identifiers
- PubChem CID
- 57750301
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 374
Related reactions
4 records
Compound notes
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