Basic information
- Standard SMILES
CCOC(=O)NC1Cc2cc(F)c(CN)cc2C1Cc1ccccc1- InChIKey
CYJBUYDETRKAOE-UHFFFAOYSA-N- Molecular formula
- C20H23FN2O2
- Average molar mass
- 342.4 g/mol
Names & identifiers
- Preferred name
- ethyl 6-(aminomethyl)-1-benzyl-5-fluoro-2,3-dihydro-1H-inden-2-ylcarbamate
- IUPAC
- ethyl N-[6-(aminomethyl)-1-benzyl-5-fluoro-2,3-dihydro-1H-inden-2-yl]carbamate
Names & synonyms
SCHEMBL604190CYJBUYDETRKAOE-UHFFFAOYSA-Nethyl 6-(aminomethyl)-1-benzyl-5-fluoro-2,3-dihydro-1H-inden-2-ylcarbamate
Database identifiers
- PubChem CID
- 66740863
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 441
Related reactions
2 records
Compound notes
Loading…