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Basic information
- Standard SMILES
CC1(c2ccccc2)CCN(C2CC2)CO1- InChIKey
VTCYIQPQDCGMPF-UHFFFAOYSA-N- Molecular formula
- C14H19NO
- Average molar mass
- 217.31 g/mol
- Monoisotopic mass
- 217.14666423
Names & identifiers
- Preferred name
- 3-Cyclopropyl-6-methyl-6-phenyl-1,3-oxazinane
- IUPAC
- 3-cyclopropyl-6-methyl-6-phenyl-1,3-oxazinane
Names & synonyms
NSC6834413-cyclopropyl-6-methyl-6-phenyl-1,3-oxazinaneCHEMBL2007949NCI60_0299143-Cyclopropyl-6-methyl-6-phenyl-1,3-oxazinane hydrochloride
Database identifiers
- PubChem CID
- 388487
- ChEMBL
CHEMBL2007949
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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