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

C20H16BrFN4O2 — CID 11419375

IUPAC4-(4-bromophenyl)-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(c2ccc(Br)cc2)CC(=O)N1
InChIInChI=1S/C20H16BrFN4O2/c1-10-19(14(7-18(27)24-10)11-2-4-13(21)5-3-11)20(28)25-17-6-12-9-23-26-16(12)8-15(17)22/h2-6,8-9,14H,7H2,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyHEEZWYFTWFVGEE-UHFFFAOYSA-N
MW443.28 g/mol
LogP3.98
Rot. Bonds3

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

4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide (PubChem CID 11419375) has the molecular formula C20H16BrFN4O2 and a molecular weight of 443.28 g/mol. Its IUPAC name is 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide.

Molecular Properties

Compound Name4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
PubChem CID11419375
Molecular FormulaC20H16BrFN4O2
Molecular Weight443.28 g/mol
Exact Mass442.04
IUPAC Name4-(4-bromophenyl)-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(c2ccc(Br)cc2)CC(=O)N1
InChIInChI=1S/C20H16BrFN4O2/c1-10-19(14(7-18(27)24-10)11-2-4-13(21)5-3-11)20(28)25-17-6-12-9-23-26-16(12)8-15(17)22/h2-6,8-9,14H,7H2,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyHEEZWYFTWFVGEE-UHFFFAOYSA-N
XLogP3.98
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.28
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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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
Gsk180736A
CID 11233873
Rho-Kinase-IN-3
CID 11269477
4-(4-fluorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11360518
Dihydropyridone indazole amide 13
CID 11453116
4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-(3-methylphenyl)-1,4-dihydropyrimidine-5-carboxamide
CID 11597345
4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxamide
CID 11697546
Dihydropyrimidinyl indazole amide 3
CID 90912537
2-bromo-N-(1H-indazol-5-yl)benzamide
CID 6466657
(4s)-4-(4-Fluorophenyl)-N-(2h-Indazol-5-Yl)-6-Methyl-2-Oxo-1,2,3,4-Tetrahydropyrimidine-5-Carboxamide
CID 117072130
2-(4-bromophenyl)-N-(1H-indazol-5-yl)acetamide
CID 6466581

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The IUPAC name of 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide (CID 11419375) is 4-(4-bromophenyl)-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-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The canonical SMILES for 4-(4-bromophenyl)-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(c2ccc(Br)cc2)CC(=O)N1.
What is the InChIKey of 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
The InChIKey is HEEZWYFTWFVGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16BrFN4O2/c1-10-19(14(7-18(27)24-10)11-2-4-13(21)5-3-11)20(28)25-17-6-12-9-23-26-16(12)8-15(17)22/h2-6,8-9,14H,7H2,1H3,(H,23,26)(H,24,27)(H,25,28).
What are the key properties of 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide?
4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide has a molecular weight of 443.28 g/mol, XLogP of 3.98, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide is sourced from PubChem (CID 11419375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).