N-Methyl-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamide
Basic information
- CAS
203585-46-0- Standard SMILES
CN(Cc1ccccc1)C(=O)c1ccc2c(c1)OCO2- InChIKey
GCFRGSSFKPOMTP-UHFFFAOYSA-N- Molecular formula
- C16H15NO3
- Average molar mass
- 269.29 g/mol
- Monoisotopic mass
- 269.10519334
Names & identifiers
- Preferred name
- N-Methyl-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamide
- IUPAC
- N-benzyl-N-methyl-1,3-benzodioxole-5-carboxamide
Names & synonyms
203585-46-0N-Methyl-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamideRefChem:364570N-benzyl-N-methyl-1,3-benzodioxole-5-carboxamideN-BENZYL-N-METHYL-2H-1,3-BENZODIOXOLE-5-CARBOXAMIDEMLS000075839BAS 01129844TimTec1_003485Oprea1_332021Benzo[1,3]dioxole-5-carboxylic acid benzyl-methyl-amideCHEMBL1491799DTXSID701201230
Show more names
HMS1543O09HMS2409C09STK080628AKOS001309165SMR000010078ST043248SR-01000322202SR-01000322202-1
Database identifiers
- CAS
203585-46-0- PubChem CID
- 654191
- DTXSID
DTXSID701201230- ChEMBL
CHEMBL1491799- Nikkaji
- J932.740A
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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