2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide

C15H16FN3O2 — CID 143439014

IUPAC2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide
SMILESCc1ccc(Nc2c(C(N)=O)cc(C)c(=O)n2C)c(F)c1
InChIInChI=1S/C15H16FN3O2/c1-8-4-5-12(11(16)6-8)18-14-10(13(17)20)7-9(2)15(21)19(14)3/h4-7,18H,1-3H3,(H2,17,20)
InChIKeyBYYKIHMKEXBLRC-UHFFFAOYSA-N
MW289.31 g/mol
LogP1.98
Rot. Bonds3

About 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide

2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide (PubChem CID 143439014) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide
PubChem CID143439014
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide
SMILESCc1ccc(Nc2c(C(N)=O)cc(C)c(=O)n2C)c(F)c1
InChIInChI=1S/C15H16FN3O2/c1-8-4-5-12(11(16)6-8)18-14-10(13(17)20)7-9(2)15(21)19(14)3/h4-7,18H,1-3H3,(H2,17,20)
InChIKeyBYYKIHMKEXBLRC-UHFFFAOYSA-N
XLogP1.98
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-ethyl-2-fluoroanilino)-1,5-dimethyl-6-oxopyridine-3-carboxylic acid
CID 91555123
CID 88870300
CID 88870300
2-(2-fluoro-4-iodoanilino)-N-methoxy-1,5-dimethyl-6-oxopyridine-3-carboxamide
CID 59342492
4-(2-fluoro-4-methylanilino)-1-methyl-6-oxopyridine-3-carboxamide
CID 11482748
5-fluoro-2-(2-fluoro-4-methylanilino)-N-(2-hydroxyethoxy)-1-methyl-6-oxopyridine-3-carboxamide
CID 143438987
3-(2-fluoro-4-methylanilino)-2-methyl-1-oxo-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbohydrazide
CID 123593181
4-fluoro-2-(2-fluoro-4-methylanilino)-3-methylbenzamide
CID 166873038
2-(4-fluoro-2-hydroxyphenyl)-N-[2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxo-3-pyridinyl]cyclopropane-1-sulfinamide
CID 90940718
6-(2-fluoro-4-methylanilino)-2,5-dimethyl-4-oxo-[1,3]thiazolo[5,4-c]pyridine-7-carboxylic acid
CID 126592205
N-[2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxo-3-pyridinyl]-2-(3-hydroxyphenyl)cyclopropane-1-sulfinamide
CID 91355660
3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
CID 143220427
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)-2-methyl-1-oxo-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxamide
CID 144761820

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide (CID 143439014) is 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide is Cc1ccc(Nc2c(C(N)=O)cc(C)c(=O)n2C)c(F)c1.
What is the InChIKey of 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide?
The InChIKey is BYYKIHMKEXBLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O2/c1-8-4-5-12(11(16)6-8)18-14-10(13(17)20)7-9(2)15(21)19(14)3/h4-7,18H,1-3H3,(H2,17,20).
What are the key properties of 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide?
2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide has a molecular weight of 289.31 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-4-methylanilino)-1,5-dimethyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 143439014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).