Basic information
- CAS
101831-53-2- Standard SMILES
COc1ccc(OC)c(NC2=NCCO2)c1- InChIKey
QMKKYQIMEGYVDH-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.10044231
Names & identifiers
- Preferred name
- Aniline, 2,5-dimethoxy-N-(2-oxazolin-2-yl)-
- IUPAC
- N-(2,5-dimethoxyphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
ANILINE, 2,5-DIMETHOXY-N-(2-OXAZOLIN-2-YL)-2-(2,5-Dimethoxyanilino)-2-oxazoline5-Methoxy-N-(2-oxazolin-2-yl)-o-anisidineo-Anisidine, 5-methoxy-N-(2-oxazolin-2-yl)-101831-53-2DTXSID30144209RefChem:319580DTXCID9066700NSC664004N-(2,5-Dimethoxyphenyl)-4,5-dihydro-1,3-oxazol-2-amineCHEMBL1978459NSC-664004
Show more names
NCI60_022022N-(2,5-dimethoxyphenyl)-4,5-dihydrooxazol-2-amineN-(4,5-Dihydro-1,3-oxazol-2-yl)-N-(2,5-dimethoxyphenyl)amine
Database identifiers
- CAS
101831-53-2- PubChem CID
- 58910
- DTXSID
DTXSID30144209- ChEMBL
CHEMBL1978459
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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