4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one

C22H18FNO3 — CID 91973087

IUPAC4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(c2ccccc2OCc2ccccc2F)c2ccc(O)cc2N1
InChIInChI=1S/C22H18FNO3/c23-19-7-3-1-5-14(19)13-27-21-8-4-2-6-17(21)18-12-22(26)24-20-11-15(25)9-10-16(18)20/h1-11,18,25H,12-13H2,(H,24,26)
InChIKeyNTNQBAHFIHAFLF-UHFFFAOYSA-N
MW363.39 g/mol
LogP4.58
Rot. Bonds4

About 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one

4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 91973087) has the molecular formula C22H18FNO3 and a molecular weight of 363.39 g/mol. Its IUPAC name is 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID91973087
Molecular FormulaC22H18FNO3
Molecular Weight363.39 g/mol
Exact Mass363.13
IUPAC Name4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(c2ccccc2OCc2ccccc2F)c2ccc(O)cc2N1
InChIInChI=1S/C22H18FNO3/c23-19-7-3-1-5-14(19)13-27-21-8-4-2-6-17(21)18-12-22(26)24-20-11-15(25)9-10-16(18)20/h1-11,18,25H,12-13H2,(H,24,26)
InChIKeyNTNQBAHFIHAFLF-UHFFFAOYSA-N
XLogP4.58
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.39
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one (CID 91973087) is 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one is O=C1CC(c2ccccc2OCc2ccccc2F)c2ccc(O)cc2N1.
What is the InChIKey of 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is NTNQBAHFIHAFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FNO3/c23-19-7-3-1-5-14(19)13-27-21-8-4-2-6-17(21)18-12-22(26)24-20-11-15(25)9-10-16(18)20/h1-11,18,25H,12-13H2,(H,24,26).
What are the key properties of 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 363.39 g/mol, XLogP of 4.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 91973087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).