7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide

C16H10F2N2O3 — CID 71463267

IUPAC7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1c(O)c2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C16H10F2N2O3/c17-8-2-1-3-10(6-8)19-15(22)13-14(21)11-5-4-9(18)7-12(11)20-16(13)23/h1-7H,(H,19,22)(H2,20,21,23)
InChIKeyVYEFSTCOOYYNTC-UHFFFAOYSA-N
MW316.26 g/mol
LogP2.76
Rot. Bonds2

About 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide

7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 71463267) has the molecular formula C16H10F2N2O3 and a molecular weight of 316.26 g/mol. Its IUPAC name is 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
PubChem CID71463267
Molecular FormulaC16H10F2N2O3
Molecular Weight316.26 g/mol
Exact Mass316.07
IUPAC Name7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1c(O)c2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C16H10F2N2O3/c17-8-2-1-3-10(6-8)19-15(22)13-14(21)11-5-4-9(18)7-12(11)20-16(13)23/h1-7H,(H,19,22)(H2,20,21,23)
InChIKeyVYEFSTCOOYYNTC-UHFFFAOYSA-N
XLogP2.76
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.26
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide (CID 71463267) is 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide is O=C(Nc1cccc(F)c1)c1c(O)c2ccc(F)cc2[nH]c1=O.
What is the InChIKey of 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is VYEFSTCOOYYNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2N2O3/c17-8-2-1-3-10(6-8)19-15(22)13-14(21)11-5-4-9(18)7-12(11)20-16(13)23/h1-7H,(H,19,22)(H2,20,21,23).
What are the key properties of 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 316.26 g/mol, XLogP of 2.76, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-(3-fluorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 71463267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).