5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide

C89H71F11N10O6 — CID 158687039

IUPAC5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3cccc(F)c3F)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3ccn(C)n3)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnc4c3C(C)(C)C(=O)N4c3ccccn3)ccc2C(F)(F)F)cc1
InChIInChI=1S/C31H23F5N2O2.C29H25F3N4O2.C29H23F3N4O2/c1-17-10-13-19(14-11-17)37-28(39)21-16-18(12-15-22(21)31(34,35)36)20-6-4-8-24-26(20)30(2,3)29(40)38(24)25-9-5-7-23(32)27(25)33;1-17-8-11-19(12-9-17)33-26(37)21-16-18(10-13-22(21)29(30,31)32)20-6-5-7-23-25(20)28(2,3)27(38)36(23)24-14-15-35(4)34-24;1-17-7-10-19(11-8-17)35-26(37)21-16-18(9-12-22(21)29(30,31)32)20-13-15-34-25-24(20)28(2,3)27(38)36(25)23-6-4-5-14-33-23/h4-16H,1-3H3,(H,37,39);5-16H,1-4H3,(H,33,37);4-16H,1-3H3,(H,35,37)
InChIKeyIFWIWLDPCXWTKB-UHFFFAOYSA-N
MW1585.59 g/mol
LogP21.47
Rot. Bonds12

About 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide

5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide (PubChem CID 158687039) has the molecular formula C89H71F11N10O6 and a molecular weight of 1585.59 g/mol. Its IUPAC name is 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
PubChem CID158687039
Molecular FormulaC89H71F11N10O6
Molecular Weight1585.59 g/mol
Exact Mass1584.54
IUPAC Name5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3cccc(F)c3F)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3ccn(C)n3)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnc4c3C(C)(C)C(=O)N4c3ccccn3)ccc2C(F)(F)F)cc1
InChIInChI=1S/C31H23F5N2O2.C29H25F3N4O2.C29H23F3N4O2/c1-17-10-13-19(14-11-17)37-28(39)21-16-18(12-15-22(21)31(34,35)36)20-6-4-8-24-26(20)30(2,3)29(40)38(24)25-9-5-7-23(32)27(25)33;1-17-8-11-19(12-9-17)33-26(37)21-16-18(10-13-22(21)29(30,31)32)20-6-5-7-23-25(20)28(2,3)27(38)36(23)24-14-15-35(4)34-24;1-17-7-10-19(11-8-17)35-26(37)21-16-18(9-12-22(21)29(30,31)32)20-13-15-34-25-24(20)28(2,3)27(38)36(25)23-6-4-5-14-33-23/h4-16H,1-3H3,(H,37,39);5-16H,1-4H3,(H,33,37);4-16H,1-3H3,(H,35,37)
InChIKeyIFWIWLDPCXWTKB-UHFFFAOYSA-N
XLogP21.47
TPSA191.83 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001585.59
LogP ≤ 521.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide with MolForge

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Related Compounds

6-(6-(4-(2-(2-(Adamantan-1-yl)acetamido)ethyl)piperazin-1-yl)pyridin-3-yl)-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-1-isopropyl-1H-indazole-4-carboxamide
CID 139211327
6-[[4-[5-acetyl-3-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]cyclohexyl]methyl]-2-(2,6-dioxopiperidin-3-yl)-5,7-dihydropyrrolo[3,4-f]isoindole-1,3-dione
CID 164919450
4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-(4-pyrazolo[1,5-a]pyrimidin-3-yltriazol-1-yl)benzamide
CID 71451816
4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[4-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)triazol-1-yl]benzamide
CID 71460801
4-ethyl-N-[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]-3-(3-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)benzamide
CID 155510467
4-methyl-N-[3-(1-methylpyrazol-4-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-yl-2-pyridinyl)amino]benzamide
CID 168299289
US9862707, Example 81
CID 118408748
US11746110, Example 15
CID 146312064
4-methyl-~{N}-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
CID 146621676
4-methyl-N-[4-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-yl-2-pyridinyl)amino]benzamide
CID 168299000
6-[6-[4-[2-(adamantane-1-carbonylamino)ethyl]piperazin-1-yl]-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-propan-2-ylindazole-4-carboxamide
CID 139413614
6-[4-[[5-acetyl-3-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]methyl]cyclohexyl]-2-(2,6-dioxopiperidin-3-yl)-5,7-dihydropyrrolo[3,4-f]isoindole-1,3-dione
CID 164919396

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide (CID 158687039) is 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide is Cc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3cccc(F)c3F)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3cccc4c3C(C)(C)C(=O)N4c3ccn(C)n3)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnc4c3C(C)(C)C(=O)N4c3ccccn3)ccc2C(F)(F)F)cc1.
What is the InChIKey of 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is IFWIWLDPCXWTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23F5N2O2.C29H25F3N4O2.C29H23F3N4O2/c1-17-10-13-19(14-11-17)37-28(39)21-16-18(12-15-22(21)31(34,35)36)20-6-4-8-24-26(20)30(2,3)29(40)38(24)25-9-5-7-23(32)27(25)33;1-17-8-11-19(12-9-17)33-26(37)21-16-18(10-13-22(21)29(30,31)32)20-6-5-7-23-25(20)28(2,3)27(38)36(23)24-14-15-35(4)34-24;1-17-7-10-19(11-8-17)35-26(37)21-16-18(9-12-22(21)29(30,31)32)20-13-15-34-25-24(20)28(2,3)27(38)36(25)23-6-4-5-14-33-23/h4-16H,1-3H3,(H,37,39);5-16H,1-4H3,(H,33,37);4-16H,1-3H3,(H,35,37).
What are the key properties of 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide?
5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide has a molecular weight of 1585.59 g/mol, XLogP of 21.47, 12 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2,3-difluorophenyl)-3,3-dimethyl-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3,3-dimethyl-1-(1-methylpyrazol-3-yl)-2-oxoindol-4-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 158687039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).