N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

C23H18FN3O3S — CID 55756905

IUPACN-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(-c2csc(NC(=O)c3ccc(-c4cccc(C)c4)[nH]c3=O)n2)cc1F
InChIInChI=1S/C23H18FN3O3S/c1-13-4-3-5-14(10-13)18-8-7-16(21(28)25-18)22(29)27-23-26-19(12-31-23)15-6-9-20(30-2)17(24)11-15/h3-12H,1-2H3,(H,25,28)(H,26,27,29)
InChIKeySLGXNQQEARQCRR-UHFFFAOYSA-N
MW435.48 g/mol
LogP4.87
Rot. Bonds5

About N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 55756905) has the molecular formula C23H18FN3O3S and a molecular weight of 435.48 g/mol. Its IUPAC name is N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID55756905
Molecular FormulaC23H18FN3O3S
Molecular Weight435.48 g/mol
Exact Mass435.11
IUPAC NameN-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(-c2csc(NC(=O)c3ccc(-c4cccc(C)c4)[nH]c3=O)n2)cc1F
InChIInChI=1S/C23H18FN3O3S/c1-13-4-3-5-14(10-13)18-8-7-16(21(28)25-18)22(29)27-23-26-19(12-31-23)15-6-9-20(30-2)17(24)11-15/h3-12H,1-2H3,(H,25,28)(H,26,27,29)
InChIKeySLGXNQQEARQCRR-UHFFFAOYSA-N
XLogP4.87
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.48
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dichloro-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 55382203
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-methoxypyridine-3-carboxamide
CID 134002964
N-[4-(4-methoxy-3-methylphenyl)-1,3-thiazol-2-yl]-2,4-dimethylbenzamide
CID 3267150
2-(dimethylamino)-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 55686455
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 27993274
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3,4,5-trimethoxy-2-nitrobenzamide
CID 55414517
(E)-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-phenylprop-2-enamide
CID 7583048
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 52636195
(E)-3-(2,3-dimethoxyphenyl)-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enamide
CID 8511573
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 868787
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-phenylimidazole-4-carboxamide
CID 60592826
N-[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 55851335

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 55756905) is N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is COc1ccc(-c2csc(NC(=O)c3ccc(-c4cccc(C)c4)[nH]c3=O)n2)cc1F.
What is the InChIKey of N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SLGXNQQEARQCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O3S/c1-13-4-3-5-14(10-13)18-8-7-16(21(28)25-18)22(29)27-23-26-19(12-31-23)15-6-9-20(30-2)17(24)11-15/h3-12H,1-2H3,(H,25,28)(H,26,27,29).
What are the key properties of N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 435.48 g/mol, XLogP of 4.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 55756905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).