Basic information
- Standard SMILES
CCOC(=O)C(C(C)C)N1CC=CC1- InChIKey
YOYBGJNWDITRAY-UHFFFAOYSA-N- Molecular formula
- C11H19NO2
- Average molar mass
- 197.27 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(2,5-dihydropyrrol-1-yl)-3-methylbutanoate
- IUPAC
- ethyl 2-(2,5-dihydropyrrol-1-yl)-3-methylbutanoate
Names & synonyms
SCHEMBL3205149
Database identifiers
- PubChem CID
- 68549119
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 215
Related reactions
1 records
Linked notes
Loading…