(2-Phenyl-quinolin-4-yl)-pyrrolidin-1-yl-methanone
Basic information
- CAS
88067-74-7- Standard SMILES
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCCC1- InChIKey
IQUUHWDMATWURW-UHFFFAOYSA-N- Molecular formula
- C20H18N2O
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.1419132
Names & identifiers
- Preferred name
- (2-Phenyl-quinolin-4-yl)-pyrrolidin-1-yl-methanone
- IUPAC
- (2-phenylquinolin-4-yl)-pyrrolidin-1-ylmethanone
Names & synonyms
88067-74-7(2-Phenyl-quinolin-4-yl)-pyrrolidin-1-yl-methanoneDTXSID40353901RefChem:206284DTXCID50304964(2-phenylquinolin-4-yl)(pyrrolidin-1-yl)methanonePyrrolidine, 1-[(2-phenyl-4-quinolinyl)carbonyl]-CBMicro_035688Cambridge id 5863476(2-phenylquinolin-4-yl)-pyrrolidin-1-ylmethanoneOprea1_194137Oprea1_368014
Show more names
MLS001217550CHEMBL1331463SCHEMBL10757593HMS2892D08STK087900AKOS000677480SMR000608270BIM-0035626.P001
Database identifiers
- CAS
88067-74-7- PubChem CID
- 757669
- DTXSID
DTXSID40353901- ChEMBL
CHEMBL1331463
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 412
Experimental & physicochemical properties
Solubility42 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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