N-(1-Cyanopropyl)-3-hydroxybenzeneacetamide
Basic information
- CAS
1247802-40-9- Standard SMILES
CCC(C#N)NC(=O)Cc1cccc(O)c1- InChIKey
BNBNSKVDJNFACR-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Names & identifiers
- Preferred name
- N-(1-Cyanopropyl)-3-hydroxybenzeneacetamide
- IUPAC
- N-(1-cyanopropyl)-2-(3-hydroxyphenyl)acetamide
Names & synonyms
DTXSID001263548AKOS010659321N-(1-Cyanopropyl)-3-hydroxybenzeneacetamideN-(1-cyanopropyl)-2-(3-hydroxyphenyl)acetamide1247802-40-9
Database identifiers
- CAS
1247802-40-9- PubChem CID
- 61399432
- DTXSID
DTXSID001263548
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…