4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide

C20H16F2N4O3 — CID 11372917

IUPAC4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
SMILESCC1=C(C(=O)Nc2cc3cn[nH]c3cc2F)C(c2cccc(O)c2F)CC(=O)N1
InChIInChI=1S/C20H16F2N4O3/c1-9-18(12(6-17(28)24-9)11-3-2-4-16(27)19(11)22)20(29)25-15-5-10-8-23-26-14(10)7-13(15)21/h2-5,7-8,12,27H,6H2,1H3,(H,23,26)(H,24,28)(H,25,29)
InChIKeyHKYUJLPENAUVER-UHFFFAOYSA-N
MW398.37 g/mol
LogP3.06
Rot. Bonds3

About 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide

4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide (PubChem CID 11372917) has the molecular formula C20H16F2N4O3 and a molecular weight of 398.37 g/mol. Its IUPAC name is 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide.

Molecular Properties

Compound Name4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
PubChem CID11372917
Molecular FormulaC20H16F2N4O3
Molecular Weight398.37 g/mol
Exact Mass398.12
IUPAC Name4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
SMILESCC1=C(C(=O)Nc2cc3cn[nH]c3cc2F)C(c2cccc(O)c2F)CC(=O)N1
InChIInChI=1S/C20H16F2N4O3/c1-9-18(12(6-17(28)24-9)11-3-2-4-16(27)19(11)22)20(29)25-15-5-10-8-23-26-14(10)7-13(15)21/h2-5,7-8,12,27H,6H2,1H3,(H,23,26)(H,24,28)(H,25,29)
InChIKeyHKYUJLPENAUVER-UHFFFAOYSA-N
XLogP3.06
TPSA107.11 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.37
LogP ≤ 53.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-(trifluoromethyl)phenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11373846
Dihydropyridone indazole amide 10
CID 11189172
4-(4-fluorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11360518
4-cyano-N-[6-(3-hydroxyphenyl)-1H-indazol-4-yl]benzamide
CID 44526760
N-[6-(4-Hydroxyphenyl)-1H-indazol-4-yl]cyclopropanecarboxamide
CID 135927892
N-(4-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxamide
CID 16099866
N-[6-(3-hydroxyphenyl)-1H-indazol-4-yl]cyclopropanecarboxamide
CID 44540126
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]-2-hydroxybenzamide
CID 22479750
1-benzyl-N-(1H-indazol-5-yl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 117073643
4-(2,4-Difluorophenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11177047
4-(4-Fluorophenyl)-N-1H-indazol-5-yl-1,2-dimethyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11199788
N-(6-fluoro-1H-indazol-5-yl)-4-(3-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
CID 11257489

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The IUPAC name of 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide (CID 11372917) is 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide.
What is the SMILES notation for 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The canonical SMILES for 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide is CC1=C(C(=O)Nc2cc3cn[nH]c3cc2F)C(c2cccc(O)c2F)CC(=O)N1.
What is the InChIKey of 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The InChIKey is HKYUJLPENAUVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N4O3/c1-9-18(12(6-17(28)24-9)11-3-2-4-16(27)19(11)22)20(29)25-15-5-10-8-23-26-14(10)7-13(15)21/h2-5,7-8,12,27H,6H2,1H3,(H,23,26)(H,24,28)(H,25,29).
What are the key properties of 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide has a molecular weight of 398.37 g/mol, XLogP of 3.06, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-3-hydroxyphenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide is sourced from PubChem (CID 11372917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).