Basic information
- CAS
54951-26-7- Standard SMILES
O=C1CCCc2ccccc2N1CC1=NCCN1- InChIKey
QJNSVIYGOVNUCN-UHFFFAOYSA-N- Molecular formula
- C14H17N3O
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.13716217
Names & identifiers
- Preferred name
- 1H-1-Benzazepin-2-one, 2,3,4,5-tetrahydro-1-(2-imidazolin-2-yl)methyl-
- IUPAC
- 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4,5-dihydro-3H-1-benzazepin-2-one
- English name
- 2,3,4,5-Tetrahydro-1-[(2-imidazolin-2-yl)methyl]-1H-1-benzazepin-2-one
- Molecular formula
- C14H17N3O
- Molecular weight
- 243.3
Names & synonyms
BRN 066685354951-26-71H-1-BENZAZEPIN-2-ONE, 2,3,4,5-TETRAHYDRO-1-(2-IMIDAZOLIN-2-YL)METHYL-DTXSID202034705-25-09-00369 (Beilstein Handbook Reference)1H-1-Benzazepin-2-one, 1-(2-imidazolin-2-yl)methyl-2,3,4,5-tetrahydro-RefChem:237219DTXCID20125961DB-2921282,3,4,5-Tetrahydro-1-[(2-imidazolin-2-yl)methyl ]-1h-1-benzazepin-2-one1-[(4,5-Dihydro-1H-imidazol-2-yl)methyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one2,3,4,5-Tetrahydro-1-[(2-imidazolin-2-yl)methyl]-1H-1-benzazepin-2-one
Show more names
2H-1-Benzazepin-2-one, 1-[(4,5-dihydro-1H-imidazol-2-yl)methyl]-1,3,4,5-tetrahydro-
Database identifiers
- CAS
54951-26-7- PubChem CID
- 41241
- DTXSID
DTXSID20203470- Nikkaji
- J149.241A
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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