7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one

C15H12FNO2 — CID 167949559

IUPAC7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(-c3cccc(O)c3)c(F)cc2N1
InChIInChI=1S/C15H12FNO2/c16-13-8-14-10(4-5-15(19)17-14)7-12(13)9-2-1-3-11(18)6-9/h1-3,6-8,18H,4-5H2,(H,17,19)
InChIKeyMPNQPONMPJMOSS-UHFFFAOYSA-N
MW257.26 g/mol
LogP3.08
Rot. Bonds1

About 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one

7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 167949559) has the molecular formula C15H12FNO2 and a molecular weight of 257.26 g/mol. Its IUPAC name is 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID167949559
Molecular FormulaC15H12FNO2
Molecular Weight257.26 g/mol
Exact Mass257.09
IUPAC Name7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(-c3cccc(O)c3)c(F)cc2N1
InChIInChI=1S/C15H12FNO2/c16-13-8-14-10(4-5-15(19)17-14)7-12(13)9-2-1-3-11(18)6-9/h1-3,6-8,18H,4-5H2,(H,17,19)
InChIKeyMPNQPONMPJMOSS-UHFFFAOYSA-N
XLogP3.08
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one (CID 167949559) is 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(-c3cccc(O)c3)c(F)cc2N1.
What is the InChIKey of 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is MPNQPONMPJMOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO2/c16-13-8-14-10(4-5-15(19)17-14)7-12(13)9-2-1-3-11(18)6-9/h1-3,6-8,18H,4-5H2,(H,17,19).
What are the key properties of 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one?
7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 257.26 g/mol, XLogP of 3.08, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-(3-hydroxyphenyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 167949559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).