Basic information
- Standard SMILES
CCCCN(C)Cc1cc(C)cc(C(=O)OC)c1- InChIKey
RAWBMDQMKJSTJO-UHFFFAOYSA-N- Molecular formula
- C15H23NO2
- Average molar mass
- 249.35 g/mol
Names & identifiers
- Preferred name
- Methyl 3-{[butyl(methyl)amino]methyl}-5-methylbenzoate
- IUPAC
- methyl 3-[[butyl(methyl)amino]methyl]-5-methylbenzoate
Names & synonyms
SCHEMBL3348375RAWBMDQMKJSTJO-UHFFFAOYSA-NMethyl 3-{[butyl(methyl)amino]methyl}-5-methylbenzoate
Database identifiers
- PubChem CID
- 21086167
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 255
Related reactions
11 records
Compound notes
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