Cycliton
Basic information
- CAS
2433-20-7- Standard SMILES
CCN(CC)C(=O)c1c(C)noc1C- InChIKey
NFALFEDRJGVKNY-UHFFFAOYSA-N- Molecular formula
- C10H16N2O2
- Average molar mass
- 196.25 g/mol
- Monoisotopic mass
- 196.12117776
Names & identifiers
- Preferred name
- Cycliton
- IUPAC
- N,N-diethyl-3,5-dimethyl-1,2-oxazole-4-carboxamide
- English name
- Cycliton
- Molecular formula
- C10H16N2O2
- Molecular weight
- 196.25
Names & synonyms
CYCLITONN,N-diethyl-3,5-dimethyl-1,2-oxazole-4-carboxamide2433-20-7OxaleptSCHEMBL27583225DTXSID80179066AKOS006243263N,N-Diethyl-3,5-dimethyl-4-isoxazolecarboxamideN,N-diethyl-3,5-dimethyl-isoxazole-4-carboxamide4-Isoxazolecarboxamide, N,N-diethyl-3,5-dimethyl-
Database identifiers
- CAS
2433-20-7- PubChem CID
- 17084
- DTXSID
DTXSID80179066- Nikkaji
- J21.587B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- Boiling point
- 143 °C · 143 °C(Press: 10 Torr)
- Density
- 1.053 · 1.053±0.06 g/cm3(Predicted)
- pka
- -1.83 · -1.83±0.70(Predicted)
- FDA UNII
- 57 K3GVX · PDL57K3GVX
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Compound notes
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