Basic information
- CAS
73941-25-0- Standard SMILES
CC(CO)NC(=O)CCc1ccc2c(c1)OCO2- InChIKey
JWJJGEGPMIHZQI-UHFFFAOYSA-N- Molecular formula
- C13H17NO4
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.11575802
Names & identifiers
- Preferred name
- Hydrocinnamamide, N-(2-hydroxy-1-methylethyl)-3,4-(methylenedioxy)-
- IUPAC
- 3-(1,3-benzodioxol-5-yl)-N-(1-hydroxypropan-2-yl)propanamide
- English name
- N-(2-Hydroxy-1-methylethyl)-3-(1,3-benzodioxol-5-yl)propanamide
- Molecular formula
- C13H17NO4
- Molecular weight
- 251.28
Names & synonyms
73941-25-0HYDROCINNAMAMIDE, N-(2-HYDROXY-1-METHYLETHYL)-3,4-(METHYLENEDIOXY)-RefChem:1086998BRN 1320875N-(2-Hydroxy-2-propyl)-3,4-methylenedioxyhydrocinnamamidePropionamide, N-(2-hydroxy-1-methylethyl)-3-(3,4-methylenedioxyphenyl)-5-19-07-00320 (Beilstein Handbook Reference)DTXSID60995160AKOS0092448663-(2H-1,3-Benzodioxol-5-yl)-N-(1-hydroxypropan-2-yl)propanimidic acid1,3-Benzodioxole-5-propanamide, N-(2-hydroxy-1-methylethyl)-N-(2-Hydroxy-1-methylethyl)-3-(1,3-benzodioxol-5-yl)propanamide
Show more names
3-benzo[1,3]dioxol-5-yl-N-(2-hydroxy-1-methyl-ethyl)-propionamide
Database identifiers
- CAS
73941-25-0- PubChem CID
- 52809
- DTXSID
DTXSID60995160- Nikkaji
- J77.813C
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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