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

C16H14FNO2 — CID 114940032

IUPAC7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccc(OCc3ccccc3F)cc2N1
InChIInChI=1S/C16H14FNO2/c17-14-4-2-1-3-12(14)10-20-13-7-5-11-6-8-16(19)18-15(11)9-13/h1-5,7,9H,6,8,10H2,(H,18,19)
InChIKeyJITWLCOQTMUEOJ-UHFFFAOYSA-N
MW271.29 g/mol
LogP3.29
Rot. Bonds3

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

7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 114940032) has the molecular formula C16H14FNO2 and a molecular weight of 271.29 g/mol. Its IUPAC name is 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID114940032
Molecular FormulaC16H14FNO2
Molecular Weight271.29 g/mol
Exact Mass271.10
IUPAC Name7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccc(OCc3ccccc3F)cc2N1
InChIInChI=1S/C16H14FNO2/c17-14-4-2-1-3-12(14)10-20-13-7-5-11-6-8-16(19)18-15(11)9-13/h1-5,7,9H,6,8,10H2,(H,18,19)
InChIKeyJITWLCOQTMUEOJ-UHFFFAOYSA-N
XLogP3.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one (CID 114940032) is 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2ccc(OCc3ccccc3F)cc2N1.
What is the InChIKey of 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is JITWLCOQTMUEOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO2/c17-14-4-2-1-3-12(14)10-20-13-7-5-11-6-8-16(19)18-15(11)9-13/h1-5,7,9H,6,8,10H2,(H,18,19).
What are the key properties of 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 271.29 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-fluorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 114940032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).