2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide

C20H19FN4O3 — CID 144833184

IUPAC2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide
SMILESCc1ccc(Nc2c(C(N)=O)c(Oc3cnccc3C)cc(=O)n2C)c(F)c1
InChIInChI=1S/C20H19FN4O3/c1-11-4-5-14(13(21)8-11)24-20-18(19(22)27)15(9-17(26)25(20)3)28-16-10-23-7-6-12(16)2/h4-10,24H,1-3H3,(H2,22,27)
InChIKeyLSSADSXLGJJZDV-UHFFFAOYSA-N
MW382.40 g/mol
LogP3.17
Rot. Bonds5

About 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide

2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide (PubChem CID 144833184) has the molecular formula C20H19FN4O3 and a molecular weight of 382.40 g/mol. Its IUPAC name is 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide
PubChem CID144833184
Molecular FormulaC20H19FN4O3
Molecular Weight382.40 g/mol
Exact Mass382.14
IUPAC Name2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide
SMILESCc1ccc(Nc2c(C(N)=O)c(Oc3cnccc3C)cc(=O)n2C)c(F)c1
InChIInChI=1S/C20H19FN4O3/c1-11-4-5-14(13(21)8-11)24-20-18(19(22)27)15(9-17(26)25(20)3)28-16-10-23-7-6-12(16)2/h4-10,24H,1-3H3,(H2,22,27)
InChIKeyLSSADSXLGJJZDV-UHFFFAOYSA-N
XLogP3.17
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.40
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethane;2-(2-fluoro-4-methylanilino)-4-(3-methoxy-2-methylphenoxy)-1-methyl-6-oxopyridine-3-carboxamide
CID 144833136
ethane;2-(2-fluoro-4-methylanilino)-1-methyl-4-[2-methyl-3-(oxolan-3-yloxy)phenoxy]-6-oxopyridine-3-carboxamide
CID 144833298
3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
CID 143220427
2-(2-fluoro-4-methylanilino)-N-[(4-methoxyphenyl)methyl]-1-methyl-4-[(5-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide
CID 144833272
2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide
CID 143439014
2-(2-fluoro-4-iodoanilino)-4-(1H-indol-4-yloxy)-1-methyl-6-oxopyridine-3-carboxamide
CID 154662807
4-[3-(ethylsulfanylamino)-2-methylphenoxy]-2-(2-fluoro-4-methylanilino)-N,1-dimethyl-6-oxopyridine-3-carboxamide
CID 144833254
2-(2-fluoro-4-iodoanilino)-1-methyl-4-[3-(3-methyl-2,4-dioxoimidazolidin-1-yl)phenoxy]-6-oxopyridine-3-carboxamide
CID 175207880
2-(2-fluoro-4-iodoanilino)-1-methyl-4-(1-nitrosoindol-4-yl)oxy-6-oxopyridine-3-carboxamide
CID 154662818
2-(2-fluoro-4-methylanilino)-N-methoxy-1-methylpyrrolo[2,3-b]pyridine-3-carboxamide
CID 142476362
4-[(1-ethylsulfonyl-2,3-dihydroindol-5-yl)oxy]-2-(2-fluoro-4-iodoanilino)-1-methyl-6-oxopyridine-3-carboxamide
CID 155040675
4-(2-fluoro-4-methylanilino)-1-methyl-6-oxopyridine-3-carboxamide
CID 11482748

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide?
The IUPAC name of 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide (CID 144833184) is 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide?
The canonical SMILES for 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide is Cc1ccc(Nc2c(C(N)=O)c(Oc3cnccc3C)cc(=O)n2C)c(F)c1.
What is the InChIKey of 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide?
The InChIKey is LSSADSXLGJJZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O3/c1-11-4-5-14(13(21)8-11)24-20-18(19(22)27)15(9-17(26)25(20)3)28-16-10-23-7-6-12(16)2/h4-10,24H,1-3H3,(H2,22,27).
What are the key properties of 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide?
2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide has a molecular weight of 382.40 g/mol, XLogP of 3.17, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-4-methylanilino)-1-methyl-4-[(4-methyl-3-pyridinyl)oxy]-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 144833184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).