N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide

C17H14FN3O2 — CID 75501253

IUPACN-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide
SMILESCCc1cc(=O)c2cc(NC(=O)c3cncc(F)c3)ccc2[nH]1
InChIInChI=1S/C17H14FN3O2/c1-2-12-7-16(22)14-6-13(3-4-15(14)20-12)21-17(23)10-5-11(18)9-19-8-10/h3-9H,2H2,1H3,(H,20,22)(H,21,23)
InChIKeyXNNCFXQFGXDERR-UHFFFAOYSA-N
MW311.32 g/mol
LogP2.88
Rot. Bonds3

About N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide

N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide (PubChem CID 75501253) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide
PubChem CID75501253
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC NameN-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide
SMILESCCc1cc(=O)c2cc(NC(=O)c3cncc(F)c3)ccc2[nH]1
InChIInChI=1S/C17H14FN3O2/c1-2-12-7-16(22)14-6-13(3-4-15(14)20-12)21-17(23)10-5-11(18)9-19-8-10/h3-9H,2H2,1H3,(H,20,22)(H,21,23)
InChIKeyXNNCFXQFGXDERR-UHFFFAOYSA-N
XLogP2.88
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-methyl-4-nitro-1H-pyrazole-3-carboxamide
CID 166202719
(3S)-N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide
CID 97259994
N-(4-bromo-3-fluorophenyl)-5-fluoropyridine-3-carboxamide
CID 115694774
N-(4-amino-3-fluorophenyl)-5-fluoropyridine-3-carboxamide
CID 104785444
N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-5-fluoropyridine-3-carboxamide
CID 131920050
5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide
CID 104786162
5-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 113287958
N-[4-(2-bromoethyl)phenyl]-5-fluoropyridine-3-carboxamide
CID 104786611
N-[4-(2-aminoethyl)phenyl]-5-fluoropyridine-3-carboxamide
CID 104785334
5-fluoro-N-[3-(methylaminomethyl)phenyl]pyridine-3-carboxamide
CID 115736760
6-tert-butyl-2-ethyl-1H-quinolin-4-one
CID 43668294
N-(3,5-difluorophenyl)-2-methyl-4-oxo-1H-quinoline-6-carboxamide
CID 39849554

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide?
The IUPAC name of N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide (CID 75501253) is N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide is CCc1cc(=O)c2cc(NC(=O)c3cncc(F)c3)ccc2[nH]1.
What is the InChIKey of N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide?
The InChIKey is XNNCFXQFGXDERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c1-2-12-7-16(22)14-6-13(3-4-15(14)20-12)21-17(23)10-5-11(18)9-19-8-10/h3-9H,2H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide?
N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide has a molecular weight of 311.32 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-4-oxo-1H-quinolin-6-yl)-5-fluoropyridine-3-carboxamide is sourced from PubChem (CID 75501253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).