6-[(3-Fluorophenyl)methoxy]-3,4-dihydroisoquinolin-1(2H)-one

HCID 22641908

Basic information

CAS
620605-88-1
Standard SMILES
O=C1NCCc2cc(OCc3cccc(F)c3)ccc21
InChIKey
DUBYHOLRDXMYAY-UHFFFAOYSA-N
Molecular formula
C16H14FNO2
Average molar mass
271.29 g/mol
Monoisotopic mass
271.10085685

Names & identifiers

Preferred name
6-[(3-Fluorophenyl)methoxy]-3,4-dihydroisoquinolin-1(2H)-one
IUPAC
6-[(3-fluorophenyl)methoxy]-3,4-dihydro-2H-isoquinolin-1-one

Names & synonyms

620605-88-1SCHEMBL4425403DTXSID30627244DUBYHOLRDXMYAY-UHFFFAOYSA-N6-[(3-Fluorophenyl)methoxy]-3,4-dihydroisoquinolin-1(2H)-oneZ21691945266-(3-Fluoro-benzyloxy)-3,4-dihydro-2H-isoquinolin-1-one

Database identifiers

CAS
620605-88-1
PubChem CID
22641908
DTXSID
DTXSID30627244

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20

Related reactions

6 records

Compound notes

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