N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide

C18H16F2N2O2 — CID 24657368

IUPACN-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCN(C(=O)C1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1
InChIInChI=1S/C18H16F2N2O2/c1-2-22(13-6-3-11(19)4-7-13)18(24)15-10-17(23)21-16-9-12(20)5-8-14(15)16/h3-9,15H,2,10H2,1H3,(H,21,23)
InChIKeyXHPXPLSOOPKOCZ-UHFFFAOYSA-N
MW330.33 g/mol
LogP3.44
Rot. Bonds3

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

N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (PubChem CID 24657368) has the molecular formula C18H16F2N2O2 and a molecular weight of 330.33 g/mol. Its IUPAC name is N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
PubChem CID24657368
Molecular FormulaC18H16F2N2O2
Molecular Weight330.33 g/mol
Exact Mass330.12
IUPAC NameN-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCN(C(=O)C1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1
InChIInChI=1S/C18H16F2N2O2/c1-2-22(13-6-3-11(19)4-7-13)18(24)15-10-17(23)21-16-9-12(20)5-8-14(15)16/h3-9,15H,2,10H2,1H3,(H,21,23)
InChIKeyXHPXPLSOOPKOCZ-UHFFFAOYSA-N
XLogP3.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The IUPAC name of N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (CID 24657368) is N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The canonical SMILES for N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is CCN(C(=O)C1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The InChIKey is XHPXPLSOOPKOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N2O2/c1-2-22(13-6-3-11(19)4-7-13)18(24)15-10-17(23)21-16-9-12(20)5-8-14(15)16/h3-9,15H,2,10H2,1H3,(H,21,23).
What are the key properties of N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide has a molecular weight of 330.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-7-fluoro-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is sourced from PubChem (CID 24657368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).