Basic information
- CAS
54981-16-7- Standard SMILES
CC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)OC(=O)N1- InChIKey
LRFPNEYFNDAGNY-UHFFFAOYSA-N- Molecular formula
- C19H25FN2O3
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.18492083
Names & identifiers
- Preferred name
- 1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 9-(3-(p-fluorobenzoyl)propyl)-5-methyl-
- IUPAC
- 9-[4-(4-fluorophenyl)-4-oxobutyl]-4-methyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
- English name
- 9-[3-(p-Fluorobenzoyl)propyl]-5-methyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
- Molecular formula
- C19H25FN2O3
- Molecular weight
- 348.41
Names & synonyms
BRN 05652131-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 9-(3-(p-fluorobenzoyl)propyl)-5-methyl-Oxo-2 methyl-5 ((fluoro-4 benzoyl)-3 propyl)-9 oxadiaza-1,3,9 spiro(5,5)undecane [French]Oxo-2 methyl-5 ((fluoro-4 benzoyl)-3 propyl)-9 oxadiaza-1,3,9 spiro(5,5)undecaneRefChem:23269254981-16-7DTXSID309703281-(4-Fluorophenyl)-4-(2-hydroxy-4-methyl-1-oxa-3,9-diazaspiro[5.5]undec-2-en-9-yl)butan-1-one9-[3-(p-Fluorobenzoyl)propyl]-5-methyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one1-Oxa-3,9-diazaspiro[5.5]undecan-2-one, 9-[4-(4-fluorophenyl)-4-oxobutyl]-5-methyl-
Database identifiers
- CAS
54981-16-7- PubChem CID
- 108297
- DTXSID
DTXSID30970328
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 483
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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