Basic information
- CAS
34190-59-5- Standard SMILES
CC(=O)NCc1cccc(OCC(O)CNC(C)C)c1- InChIKey
XNRDORAWRWVUEG-UHFFFAOYSA-N- Molecular formula
- C15H24N2O3
- Average molar mass
- 280.36 g/mol
- Monoisotopic mass
- 280.17869263
Names & identifiers
- Preferred name
- N-[(3-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)methyl]acetamide
- IUPAC
- N-[[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]methyl]acetamide
Names & synonyms
CHEMBL3272383DTXSID40874747N-[(3-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)methyl]acetamide34190-59-5N-[[3-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]methyl]acetamide
Database identifiers
- CAS
34190-59-5- PubChem CID
- 12376496
- DTXSID
DTXSID40874747- ChEMBL
CHEMBL3272383- Nikkaji
- J1.584.415I
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 284
Experimental & physicochemical properties
LogP0.34
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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