(S)-4-(1-methyl-2-phenyl-ethyl)-4,5-dihydro-oxazol-2-ylamine
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Basic information
- Standard SMILES
CC(Cc1ccccc1)[C@H]1COC(N)=N1- InChIKey
USSJBVDACSRTDB-HCCKASOXSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
Names & identifiers
- Preferred name
- (S)-4-(1-methyl-2-phenyl-ethyl)-4,5-dihydro-oxazol-2-ylamine
- IUPAC
- (4S)-4-(1-phenylpropan-2-yl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
SCHEMBL3611965CHEMBL3684781USSJBVDACSRTDB-HCCKASOXSA-NBDBM109430US8604061, 154(S)-4-(1-methyl-2-phenyl-ethyl)-4,5-dihydro-oxazol-2-ylamine
Database identifiers
- PubChem CID
- 24968258
- ChEMBL
CHEMBL3684781
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
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Related reactions
1 records
Compound notes
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