5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide

C21H19FN2O3 — CID 78320582

IUPAC5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide
SMILESCC(C)c1ccc(Oc2ccc(F)cc2C(=O)Nc2cc[nH]c(=O)c2)cc1
InChIInChI=1S/C21H19FN2O3/c1-13(2)14-3-6-17(7-4-14)27-19-8-5-15(22)11-18(19)21(26)24-16-9-10-23-20(25)12-16/h3-13H,1-2H3,(H2,23,24,25,26)
InChIKeyGNEXXGMTEPRYJA-UHFFFAOYSA-N
MW366.39 g/mol
LogP4.68
Rot. Bonds5

About 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide

5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide (PubChem CID 78320582) has the molecular formula C21H19FN2O3 and a molecular weight of 366.39 g/mol. Its IUPAC name is 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide.

Molecular Properties

Compound Name5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide
PubChem CID78320582
Molecular FormulaC21H19FN2O3
Molecular Weight366.39 g/mol
Exact Mass366.14
IUPAC Name5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide
SMILESCC(C)c1ccc(Oc2ccc(F)cc2C(=O)Nc2cc[nH]c(=O)c2)cc1
InChIInChI=1S/C21H19FN2O3/c1-13(2)14-3-6-17(7-4-14)27-19-8-5-15(22)11-18(19)21(26)24-16-9-10-23-20(25)12-16/h3-13H,1-2H3,(H2,23,24,25,26)
InChIKeyGNEXXGMTEPRYJA-UHFFFAOYSA-N
XLogP4.68
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.39
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxo-1H-pyridin-4-yl)-2-(4-propoxyphenoxy)-5-(trifluoromethyl)benzamide
CID 78323101
4-methylphenol;2-(4-methylphenoxy)-N-(2-oxo-1H-pyridin-4-yl)-5-(trifluoromethoxy)benzamide
CID 157153109
5-chloro-2-(4-fluoro-2-propan-2-ylphenoxy)-N-(2-oxo-1H-pyridin-4-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 177358502
1-[5-fluoro-2-(4-fluorophenoxy)phenyl]ethanone
CID 14797581
2-(2,4-difluorophenoxy)-4-(fluoromethyl)-N-(2-oxo-1H-pyridin-4-yl)benzamide
CID 118350357
2-(4-chloro-2-fluorophenoxy)-N-(2-oxo-1H-pyridin-4-yl)-5-(trifluoromethyl)benzamide
CID 78323102
5-(fluoromethyl)-2-(2-methylpropoxy)-N-(2-oxo-1H-pyridin-4-yl)benzamide
CID 90306153
4-chloro-2-fluorophenol;2-(4-chloro-2-fluorophenoxy)-N-(2-oxo-1H-pyridin-4-yl)-5-(trifluoromethyl)benzamide
CID 160785317
2-[4-fluoro-2-[3-(methylamino)propoxy]phenoxy]-N-(2-oxo-1H-pyridin-4-yl)-5-(trifluoromethyl)pyridine-3-carboxamide
CID 177357924
N-(2-oxo-1H-pyridin-4-yl)-5-(trifluoromethyl)-2-(2,4,5-trimethylphenoxy)benzamide;2,4,5-trimethylphenol
CID 158204256
N-(3-fluorophenyl)-2-phenoxybenzamide
CID 876611
N-(2-oxo-1H-pyridin-4-yl)-4-(trifluoromethyl)-2-[[6-(trifluoromethyl)-3-pyridinyl]oxy]benzamide
CID 90034791

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide?
The IUPAC name of 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide (CID 78320582) is 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide.
What is the SMILES notation for 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide?
The canonical SMILES for 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide is CC(C)c1ccc(Oc2ccc(F)cc2C(=O)Nc2cc[nH]c(=O)c2)cc1.
What is the InChIKey of 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide?
The InChIKey is GNEXXGMTEPRYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O3/c1-13(2)14-3-6-17(7-4-14)27-19-8-5-15(22)11-18(19)21(26)24-16-9-10-23-20(25)12-16/h3-13H,1-2H3,(H2,23,24,25,26).
What are the key properties of 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide?
5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide has a molecular weight of 366.39 g/mol, XLogP of 4.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(2-oxo-1H-pyridin-4-yl)-2-(4-propan-2-ylphenoxy)benzamide is sourced from PubChem (CID 78320582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).