N-(4-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Basic information
- CAS
7632-95-3- Standard SMILES
Cc1ccc(NC2=NCCO2)cc1- InChIKey
NEVRAXFZOXHXAV-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.09496301
Names & identifiers
- Preferred name
- N-(4-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
- IUPAC
- N-(4-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
7632-95-3NSC102870N-(4-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amineCHEMBL390100DTXSID40997687NSC-102870DS-0135202-OXAZOLAMINE,4,5-DIHYDRO-N-(4-METHYLPHENYL)-
Database identifiers
- CAS
7632-95-3- PubChem CID
- 265994
- DTXSID
DTXSID40997687- ChEMBL
CHEMBL390100
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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