7-[(4,5-Dihydro-1H-imidazol-2-yl)amino]-3,4-dihydro-1(2H)-naphthalenone
Basic information
- CAS
214697-96-8- Standard SMILES
O=C1CCCc2ccc(NC3=NCCN3)cc21- InChIKey
PNEJFIKHFMAKJJ-UHFFFAOYSA-N- Molecular formula
- C13H15N3O
- Average molar mass
- 229.28 g/mol
- Monoisotopic mass
- 229.12151211
Names & identifiers
- Preferred name
- 7-[(4,5-Dihydro-1H-imidazol-2-yl)amino]-3,4-dihydro-1(2H)-naphthalenone
- IUPAC
- 7-(4,5-dihydro-1H-imidazol-2-ylamino)-3,4-dihydro-2H-naphthalen-1-one
Names & synonyms
SCHEMBL6776877DTXSID1011513907-[(4,5-Dihydro-1H-imidazol-2-yl)amino]-3,4-dihydro-1(2H)-naphthalenone214697-96-87-[(4,5-Dihydro-1H-imidazol-2-yl)amino]-3,4-dihydronaphthalen-1(2H)-one
Database identifiers
- CAS
214697-96-8- PubChem CID
- 15840804
- DTXSID
DTXSID101151390
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…