Basic information
- Standard SMILES
COC(=O)NCc1cccc(C(=O)C=CN(C)C)c1- InChIKey
ZBIMQVDFCFPLRA-UHFFFAOYSA-N- Molecular formula
- C14H18N2O3
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.13174244
Names & identifiers
- Preferred name
- [3-[3-(Dimethylamino)-1-oxo-2-propenyl]phenyl]methylcarbamic acid, methyl ester
- IUPAC
- methyl N-[[3-[3-(dimethylamino)prop-2-enoyl]phenyl]methyl]carbamate
Names & synonyms
ZBIMQVDFCFPLRA-UHFFFAOYSA-N[3-[3-(dimethylamino)-1-oxo-2-propenyl]phenyl]methylcarbamic acid, methyl ester
Database identifiers
- PubChem CID
- 86741391
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
1 records
Compound notes
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