N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide

C26H21F2N5O3 — CID 167268064

IUPACN-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide
SMILESCc1ccc(-n2c(C)ccc(C(=O)Nc3ccc(NC(=O)c4cc(F)cnc4N)c(F)c3)c2=O)cc1
InChIInChI=1S/C26H21F2N5O3/c1-14-3-7-18(8-4-14)33-15(2)5-9-19(26(33)36)24(34)31-17-6-10-22(21(28)12-17)32-25(35)20-11-16(27)13-30-23(20)29/h3-13H,1-2H3,(H2,29,30)(H,31,34)(H,32,35)
InChIKeyQTNDBZAOZOSVAB-UHFFFAOYSA-N
MW489.48 g/mol
LogP4.21
Rot. Bonds5

About N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide

N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide (PubChem CID 167268064) has the molecular formula C26H21F2N5O3 and a molecular weight of 489.48 g/mol. Its IUPAC name is N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide
PubChem CID167268064
Molecular FormulaC26H21F2N5O3
Molecular Weight489.48 g/mol
Exact Mass489.16
IUPAC NameN-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide
SMILESCc1ccc(-n2c(C)ccc(C(=O)Nc3ccc(NC(=O)c4cc(F)cnc4N)c(F)c3)c2=O)cc1
InChIInChI=1S/C26H21F2N5O3/c1-14-3-7-18(8-4-14)33-15(2)5-9-19(26(33)36)24(34)31-17-6-10-22(21(28)12-17)32-25(35)20-11-16(27)13-30-23(20)29/h3-13H,1-2H3,(H2,29,30)(H,31,34)(H,32,35)
InChIKeyQTNDBZAOZOSVAB-UHFFFAOYSA-N
XLogP4.21
TPSA119.11 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.48
LogP ≤ 54.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(6-amino-5-chloropyrimidin-4-yl)oxy-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide
CID 167268776
N-[4-[(6-amino-1H-indazol-5-yl)oxy]-3-fluorophenyl]-6-methyl-2-oxo-1-phenylpyridine-3-carboxamide
CID 59159924
2-amino-4-fluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 63109760
N-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CID 167268113
2-amino-5-bromo-N-(4-bromo-3-fluorophenyl)pyridine-3-carboxamide
CID 65437608
N-[3-fluoro-4-[[2-(2-iminoethyl)-5-(1-methylimidazol-4-yl)-3-pyridinyl]oxy]phenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
CID 123500318
N-[3-fluoro-4-[2-(4-oxopentanoylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
CID 46240360
N-[3-fluoro-4-[(6-morpholin-4-yl-1H-indazol-5-yl)oxy]phenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
CID 59159943
N-[3-fluoro-4-[2-(3-methylsulfanylpropanoylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
CID 46241921
2-amino-5-fluoro-N-(3-fluoro-4-methylphenyl)benzamide
CID 43245678
tert-butyl 4-[[3-amino-6-(4-methylphenyl)pyrazine-2-carbonyl]amino]-2-fluorobenzoate
CID 156817166
2-chloro-5-fluoro-N-(2-fluoro-5-methylphenyl)pyridine-3-carboxamide
CID 113347090

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide (CID 167268064) is N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide is Cc1ccc(-n2c(C)ccc(C(=O)Nc3ccc(NC(=O)c4cc(F)cnc4N)c(F)c3)c2=O)cc1.
What is the InChIKey of N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is QTNDBZAOZOSVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21F2N5O3/c1-14-3-7-18(8-4-14)33-15(2)5-9-19(26(33)36)24(34)31-17-6-10-22(21(28)12-17)32-25(35)20-11-16(27)13-30-23(20)29/h3-13H,1-2H3,(H2,29,30)(H,31,34)(H,32,35).
What are the key properties of N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide?
N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 489.48 g/mol, XLogP of 4.21, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-amino-5-fluoropyridine-3-carbonyl)amino]-3-fluorophenyl]-6-methyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 167268064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).