Basic information
- CAS
40520-30-7- Standard SMILES
COc1ccc(NC2=NCCO2)c2c1CCCC2- InChIKey
SFQNHUGBLWODEZ-UHFFFAOYSA-N- Molecular formula
- C14H18N2O2
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.13682782
Names & identifiers
- Preferred name
- 1-Naphthylamine, 5,6,7,8-tetrahydro-4-methoxy-N-(2-oxazolin-2-yl)-
- IUPAC
- N-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
1-NAPHTHYLAMINE, 5,6,7,8-TETRAHYDRO-4-METHOXY-N-(2-OXAZOLIN-2-YL)-40520-30-72-(5,6,7,8-Tetrahydro-4-methoxy-1-naphthylamino)-2-oxazolineDTXSID701935342-((4-Methoxy-5,6,7,8-tetrahydro-1-naphthyl)amino)-2-oxazoline2-Oxazoline, 2-((4-methoxy-5,6,7,8-tetrahydro-1-naphthyl)amino)-RefChem:232390DTXCID10116025NSC663996NCIMech_000471N-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)-4,5-dihydro-1,3-oxazol-2-amineCHEMBL1996180
Show more names
CCG-35692NSC-663996NCI60_022014PD011699N-(8-methoxytetralin-5-yl)-4,5-dihydrooxazol-2-amineN-(4,5-Dihydro-1,3-oxazol-2-yl)-N-(4-methoxy-5,6,7,8-tetrahydro-1-naphthalenyl)amineN-(4-Methoxy-5,6,7,8-tetrahydro-1-naphthalenyl)-4,5-dihydro-1,3-oxazol-2-amine
Database identifiers
- CAS
40520-30-7- PubChem CID
- 38508
- DTXSID
DTXSID70193534- ChEMBL
CHEMBL1996180- Nikkaji
- J61.715F
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 319
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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