N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide

C16H11FN4O3 — CID 58337549

IUPACN-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(Nc1cc(F)cc(Oc2cncnc2)c1)c1cc(=O)cc[nH]1
InChIInChI=1S/C16H11FN4O3/c17-10-3-11(21-16(23)15-6-12(22)1-2-20-15)5-13(4-10)24-14-7-18-9-19-8-14/h1-9H,(H,20,22)(H,21,23)
InChIKeyCZOJVEALAPBNIS-UHFFFAOYSA-N
MW326.29 g/mol
LogP2.35
Rot. Bonds4

About N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide

N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 58337549) has the molecular formula C16H11FN4O3 and a molecular weight of 326.29 g/mol. Its IUPAC name is N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide
PubChem CID58337549
Molecular FormulaC16H11FN4O3
Molecular Weight326.29 g/mol
Exact Mass326.08
IUPAC NameN-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(Nc1cc(F)cc(Oc2cncnc2)c1)c1cc(=O)cc[nH]1
InChIInChI=1S/C16H11FN4O3/c17-10-3-11(21-16(23)15-6-12(22)1-2-20-15)5-13(4-10)24-14-7-18-9-19-8-14/h1-9H,(H,20,22)(H,21,23)
InChIKeyCZOJVEALAPBNIS-UHFFFAOYSA-N
XLogP2.35
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.29
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-(trihydroxymethoxy)pyridine-2-carboxamide
CID 123947462
N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-3-methylbenzamide;3-methyl-N-(3-pyrimidin-5-yloxyphenyl)benzamide
CID 123377102
N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-2-(trifluoromethyl)-1,3-thiazole-4-carboxamide
CID 58337687
N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide
CID 110863623
N-(3,4-dimethyl-5-pyrimidin-5-yloxyphenyl)-5-fluoropyridine-2-carboxamide
CID 123137706
4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
CID 10172758
N-[3-amino-5-(4-fluorophenoxy)phenyl]pyridine-4-carboxamide
CID 5213441
3-(dimethylsulfamoyl)-N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)benzamide;3-methyl-N-[3-pyrimidin-5-yloxy-5-(trifluoromethyl)phenyl]benzamide
CID 159213971
N-(3,4-difluoro-5-pyrimidin-5-yloxyphenyl)-2-fluoro-3-methylbenzamide;3-ethynyl-2-fluoro-N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)benzamide;3-ethynyl-4-fluoro-N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)benzamide
CID 123507104
N-(3,5-difluorophenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 45030497
2-oxo-N-pyrimidin-5-yl-1H-pyridine-4-carboxamide
CID 104862699
5-cyano-N-(3,4-difluoro-5-pyrimidin-5-yloxyphenyl)-2-fluorobenzamide
CID 58337587

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide (CID 58337549) is N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide is O=C(Nc1cc(F)cc(Oc2cncnc2)c1)c1cc(=O)cc[nH]1.
What is the InChIKey of N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is CZOJVEALAPBNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN4O3/c17-10-3-11(21-16(23)15-6-12(22)1-2-20-15)5-13(4-10)24-14-7-18-9-19-8-14/h1-9H,(H,20,22)(H,21,23).
What are the key properties of N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide?
N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 326.29 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 58337549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).