7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one

C15H11F2NO2 — CID 66650407

IUPAC7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one
SMILESO=C1Cc2ccc(F)cc2NC1c1ccc(O)cc1F
InChIInChI=1S/C15H11F2NO2/c16-9-2-1-8-5-14(20)15(18-13(8)6-9)11-4-3-10(19)7-12(11)17/h1-4,6-7,15,18-19H,5H2
InChIKeyZCGKKASOVXQCRM-UHFFFAOYSA-N
MW275.25 g/mol
LogP2.95
Rot. Bonds1

About 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one

7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one (PubChem CID 66650407) has the molecular formula C15H11F2NO2 and a molecular weight of 275.25 g/mol. Its IUPAC name is 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one.

Molecular Properties

Compound Name7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one
PubChem CID66650407
Molecular FormulaC15H11F2NO2
Molecular Weight275.25 g/mol
Exact Mass275.08
IUPAC Name7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one
SMILESO=C1Cc2ccc(F)cc2NC1c1ccc(O)cc1F
InChIInChI=1S/C15H11F2NO2/c16-9-2-1-8-5-14(20)15(18-13(8)6-9)11-4-3-10(19)7-12(11)17/h1-4,6-7,15,18-19H,5H2
InChIKeyZCGKKASOVXQCRM-UHFFFAOYSA-N
XLogP2.95
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one?
The IUPAC name of 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one (CID 66650407) is 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one.
What is the SMILES notation for 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one?
The canonical SMILES for 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one is O=C1Cc2ccc(F)cc2NC1c1ccc(O)cc1F.
What is the InChIKey of 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one?
The InChIKey is ZCGKKASOVXQCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2NO2/c16-9-2-1-8-5-14(20)15(18-13(8)6-9)11-4-3-10(19)7-12(11)17/h1-4,6-7,15,18-19H,5H2.
What are the key properties of 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one?
7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one has a molecular weight of 275.25 g/mol, XLogP of 2.95, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one is sourced from PubChem (CID 66650407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).