Basic information
- Standard SMILES
CC(=O)c1cccc(OCC(O)CN(C(C)C)C(C)C)c1- InChIKey
NIDGVUXXKZQYKG-UHFFFAOYSA-N- Molecular formula
- C17H27NO3
- Average molar mass
- 293.4 g/mol
- Monoisotopic mass
- 293.19909372
Names & identifiers
- Preferred name
- 1-[3-[3-[Di(propan-2-yl)amino]-2-hydroxypropoxy]phenyl]ethanone
- IUPAC
- 1-[3-[3-[di(propan-2-yl)amino]-2-hydroxypropoxy]phenyl]ethanone
Names & synonyms
DTXSID0013844351-[3-[3-[di(propan-2-yl)amino]-2-hydroxypropoxy]phenyl]ethanone
Database identifiers
- PubChem CID
- 46181
- DTXSID
DTXSID001384435
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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