N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide

C22H20FN3O4 — CID 175645549

IUPACN-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1ccccc1-n1ccc(C)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)c1=O
InChIInChI=1S/C22H20FN3O4/c1-13-10-11-26(18-6-4-5-7-19(18)30-3)22(29)20(13)21(28)25-15-8-9-16(23)17(12-15)24-14(2)27/h4-12H,1-3H3,(H,24,27)(H,25,28)
InChIKeyIKQIPDORWFMYNB-UHFFFAOYSA-N
MW409.42 g/mol
LogP3.50
Rot. Bonds5

About N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide

N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide (PubChem CID 175645549) has the molecular formula C22H20FN3O4 and a molecular weight of 409.42 g/mol. Its IUPAC name is N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide
PubChem CID175645549
Molecular FormulaC22H20FN3O4
Molecular Weight409.42 g/mol
Exact Mass409.14
IUPAC NameN-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1ccccc1-n1ccc(C)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)c1=O
InChIInChI=1S/C22H20FN3O4/c1-13-10-11-26(18-6-4-5-7-19(18)30-3)22(29)20(13)21(28)25-15-8-9-16(23)17(12-15)24-14(2)27/h4-12H,1-3H3,(H,24,27)(H,25,28)
InChIKeyIKQIPDORWFMYNB-UHFFFAOYSA-N
XLogP3.50
TPSA89.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.42
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxyphenyl)-4-methyl-N-(1-methylpyrazol-4-yl)-2-oxopyridine-3-carboxamide
CID 172658075
N-[2-(2-hydroxyethyl)phenyl]-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide
CID 172672235
3-(azocane-1-carbonyl)-1-(2-methoxyphenyl)-4-methylpyridin-2-one
CID 172663458
methyl 1-[1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carbonyl]azetidine-3-carboxylate
CID 172656047
1-(2-methoxyphenyl)-4-methyl-N-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl]-2-oxopyridine-3-carboxamide
CID 172674309
N-(3-acetamido-4-fluorophenyl)-4-methoxybenzamide
CID 52559110
N-[(3-chloro-2-pyridinyl)methyl]-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide
CID 172666735
N-(3-fluoro-4-methoxyphenyl)-2,6-dimethoxybenzamide
CID 110776470
2-amino-N-(4-fluoro-3-methoxyphenyl)-6-methylbenzamide
CID 114836825
1-(2-methoxyphenyl)-4-methyl-N-(1-oxa-9-azaspiro[5.5]undecan-5-yl)-2-oxopyridine-3-carboxamide;hydrochloride
CID 172911869
2,6-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776411
N-(3-acetamido-4-methoxyphenyl)-2,4-difluorobenzamide
CID 33307531

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide (CID 175645549) is N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide is COc1ccccc1-n1ccc(C)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)c1=O.
What is the InChIKey of N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is IKQIPDORWFMYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O4/c1-13-10-11-26(18-6-4-5-7-19(18)30-3)22(29)20(13)21(28)25-15-8-9-16(23)17(12-15)24-14(2)27/h4-12H,1-3H3,(H,24,27)(H,25,28).
What are the key properties of N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide?
N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 409.42 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-fluorophenyl)-1-(2-methoxyphenyl)-4-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 175645549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).