Basic information
- Standard SMILES
COc1c(C)cc(NC2(CC(=O)O)CCC2)cc1C- InChIKey
LKQMPKASCRNYKX-UHFFFAOYSA-N- Molecular formula
- C15H21NO3
- Average molar mass
- 263.33 g/mol
- Monoisotopic mass
- 263.15214353
Names & identifiers
- Preferred name
- 2-(1-(4-Methoxy-3,5-dimethylphenylamino)cyclobutyl)acetic acid
- IUPAC
- 2-[1-(4-methoxy-3,5-dimethylanilino)cyclobutyl]acetic acid
Names & synonyms
SCHEMBL4472618LKQMPKASCRNYKX-UHFFFAOYSA-N2-(1-(4-methoxy-3,5-dimethylphenylamino)-cyclobutyl)acetic acid2-(1-(4-methoxy-3,5-dimethylphenylamino)cyclobutyl)acetic acid
Database identifiers
- PubChem CID
- 69056589
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 315
Related reactions
4 records
Compound notes
Loading…