N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one

C115H120F4N22O7 — CID 159570348

IUPACN,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one
SMILESCC(C)c1cc(C(F)(F)F)nn1CC(=O)N(C)C.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)cn1.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)nc1.CC(C)c1cnc(-c2cc[nH]c(=O)c2)nc1.CC(C)c1cnc(-c2cccc3c2CC(=O)N3)cc1C#N.CC(C)c1cnc(-c2cccc3c2CC(=O)N3C)nc1.CC(C)c1cnc(-c2ccnnc2)nc1.CC(C)c1ncc(-c2cccc3c2CC(=O)N3)cc1F
InChIInChI=1S/C17H15N3O.C16H15FN2O.C16H17N3O.2C16H16N2O.C12H13N3O.C11H16F3N3O.C11H12N4/c1-10(2)14-9-19-16(6-11(14)8-18)12-4-3-5-15-13(12)7-17(21)20-15;1-9(2)16-13(17)6-10(8-18-16)11-4-3-5-14-12(11)7-15(20)19-14;1-10(2)11-8-17-16(18-9-11)12-5-4-6-14-13(12)7-15(20)19(14)3;1-10(2)14-7-6-11(9-17-14)12-4-3-5-15-13(12)8-16(19)18-15;1-10(2)11-6-7-14(17-9-11)12-4-3-5-15-13(12)8-16(19)18-15;1-8(2)10-6-14-12(15-7-10)9-3-4-13-11(16)5-9;1-7(2)8-5-9(11(12,13)14)15-17(8)6-10(18)16(3)4;1-8(2)10-5-12-11(13-6-10)9-3-4-14-15-7-9/h3-6,9-10H,7H2,1-2H3,(H,20,21);3-6,8-9H,7H2,1-2H3,(H,19,20);4-6,8-10H,7H2,1-3H3;2*3-7,9-10H,8H2,1-2H3,(H,18,19);3-8H,1-2H3,(H,13,16);5,7H,6H2,1-4H3;3-8H,1-2H3
InChIKeyMHSQIXLBICKGGV-UHFFFAOYSA-N
MW1998.36 g/mol
LogP22.39
Rot. Bonds17

About N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one

N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one (PubChem CID 159570348) has the molecular formula C115H120F4N22O7 and a molecular weight of 1998.36 g/mol. Its IUPAC name is N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound NameN,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one
PubChem CID159570348
Molecular FormulaC115H120F4N22O7
Molecular Weight1998.36 g/mol
Exact Mass1996.96
IUPAC NameN,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one
SMILESCC(C)c1cc(C(F)(F)F)nn1CC(=O)N(C)C.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)cn1.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)nc1.CC(C)c1cnc(-c2cc[nH]c(=O)c2)nc1.CC(C)c1cnc(-c2cccc3c2CC(=O)N3)cc1C#N.CC(C)c1cnc(-c2cccc3c2CC(=O)N3C)nc1.CC(C)c1cnc(-c2ccnnc2)nc1.CC(C)c1ncc(-c2cccc3c2CC(=O)N3)cc1F
InChIInChI=1S/C17H15N3O.C16H15FN2O.C16H17N3O.2C16H16N2O.C12H13N3O.C11H16F3N3O.C11H12N4/c1-10(2)14-9-19-16(6-11(14)8-18)12-4-3-5-15-13(12)7-17(21)20-15;1-9(2)16-13(17)6-10(8-18-16)11-4-3-5-14-12(11)7-15(20)19-14;1-10(2)11-8-17-16(18-9-11)12-5-4-6-14-13(12)7-15(20)19(14)3;1-10(2)14-7-6-11(9-17-14)12-4-3-5-15-13(12)8-16(19)18-15;1-10(2)11-6-7-14(17-9-11)12-4-3-5-15-13(12)8-16(19)18-15;1-8(2)10-6-14-12(15-7-10)9-3-4-13-11(16)5-9;1-7(2)8-5-9(11(12,13)14)15-17(8)6-10(18)16(3)4;1-8(2)10-5-12-11(13-6-10)9-3-4-14-15-7-9/h3-6,9-10H,7H2,1-2H3,(H,20,21);3-6,8-9H,7H2,1-2H3,(H,19,20);4-6,8-10H,7H2,1-3H3;2*3-7,9-10H,8H2,1-2H3,(H,18,19);3-8H,1-2H3,(H,13,16);5,7H,6H2,1-4H3;3-8H,1-2H3
InChIKeyMHSQIXLBICKGGV-UHFFFAOYSA-N
XLogP22.39
TPSA386.17 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds17
Heavy Atoms148
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001998.36
LogP ≤ 522.39
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Analyze N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one with MolForge

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Related Compounds

4-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3-[4-[2-(4-imidazol-1-ylanilino)pyrimidin-4-yl]pyrazol-1-yl]butanenitrile;3-[3-(dimethylamino)propylamino]-N-[6-methyl-5-(9H-pyrimido[4,5-b]indol-7-yl)-3-pyridinyl]-5-(trifluoromethyl)benzamide
CID 89905037
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(4-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-isocyano-4-pyridinyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 90773520
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-isocyano-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 91467421
5-[1-(3,3-difluoro-2,2-dimethylpropyl)pyrazol-4-yl]-6-[7-[3-[4-[2-[2-[2-[4-[5-fluoro-4-(2-imidazo[1,2-a]pyridin-7-yl-6-methylpyridin-3-yl)pyrazol-1-yl]-2-methylbutyl]cyclopropyl]-3-oxo-1H-isoindol-5-yl]-6-methylpyridin-3-yl]pyrazol-1-yl]-2-methylpropyl]-2-methyl-3-oxo-1H-isoindol-5-yl]pyridine-2-carbonitrile
CID 137390007
2-(2,6-difluorophenyl)-N-[(3S)-9-fluoro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(2-fluoro-4-pyrrolidin-1-ylphenyl)-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;6-methyl-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 156095640
4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]benzamide;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]benzamide;2-[4-methyl-3-[(5-methyl-2-pyridin-4-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]phenyl]-1-[3-(trifluoromethyl)phenyl]ethanone;4-methyl-3-[(5-methyl-2-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide;4-methyl-3-[(5-methyl-2-pyridin-4-ylpyrrolo[3,2-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 157053327
5-[8-amino-3-[(2-cyanocyclopropanecarbonyl)amino]isoquinolin-6-yl]-N,1-dimethylpyrazole-3-carboxamide;N-[8-amino-7-cyano-6-(2-methylphenyl)isoquinolin-3-yl]-2-cyanocyclopropane-1-carboxamide;N-[8-amino-6-(6-methylimidazo[1,2-a]pyridin-7-yl)isoquinolin-3-yl]-2-cyanocyclopropane-1-carboxamide;N-[8-amino-6-(1H-pyrrol-3-yl)isoquinolin-3-yl]-2-cyanocyclopropane-1-carboxamide;N-[8-amino-6-[5-(trifluoromethyl)-2H-pyrrol-4-yl]isoquinolin-3-yl]-2-cyanocyclopropane-1-carboxamide
CID 157129293
N-benzyl-6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carboxamide;N-cyclohexyl-6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carboxamide;N-(3,3-diphenylpropyl)-6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carboxamide;N-hexyl-6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carboxamide;N-(2-phenylethyl)-4-[5-pyridin-3-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide;N-(3-phenylpropyl)-4-[5-pyridin-3-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide
CID 157141744
N-[(1S)-1-[3-(3-acetamido-4-fluorophenyl)-2-pyridinyl]-2-(3,5-difluorophenyl)ethyl]-2-(5-fluoro-1H-indol-3-yl)acetamide;(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-5-(3,5-difluorophenyl)-1-[2-fluoro-9-(trifluoromethyl)-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]pentan-2-one;(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-5-(3,5-difluorophenyl)-1-(4,5,6,7-tetrahydroindazol-1-yl)pentan-2-one;5-(3,5-difluorophenyl)-1-(5,6-dimethylbenzimidazol-1-yl)-4-[3-(4-methylphenyl)pyrazin-2-yl]pentan-2-one;(4R)-5-(3,5-difluorophenyl)-1-(5-fluoro-1H-indol-3-yl)-4-[3-(4-fluoro-3-methylphenyl)-2-pyridinyl]pentan-2-one;5-(3,5-difluorophenyl)-4-[3-(4-methylphenyl)-2-pyridinyl]-1-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]pentan-2-one
CID 157142748
2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;3-fluoro-5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;1-methyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;4-propan-2-yl-1,3-dihydroindol-2-one;1-(3-propan-2-ylindol-1-yl)ethanone;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;3-propan-2-ylpyridine-4-carbonitrile;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine
CID 157184130
N,N-dimethyl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-[(1-methylpiperidin-4-yl)methyl]-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(2-piperazin-1-ylethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(piperidin-4-ylmethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-piperidin-4-yl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157192480
(3S,4R)-1-[2-[(2S)-1-(3,6-dichloropyridine-2-carbonyl)piperidin-2-yl]-6-methylpyrazolo[1,5-a]pyrimidin-5-yl]-4-methylpyrrolidine-3-carbonitrile;(3S,4R)-1-[2-[(2S)-1-(2,4-difluorobenzoyl)piperidin-2-yl]-6-methylpyrazolo[1,5-a]pyrimidin-5-yl]-4-methylpyrrolidine-3-carbonitrile;(3S,4R)-1-[2-[(2S)-1-(3,4-difluoro-2-methylbenzoyl)piperidin-2-yl]-6-methylpyrazolo[1,5-a]pyrimidin-5-yl]-4-methylpyrrolidine-3-carbonitrile;(3S,4R)-1-[2-[(2S)-1-(4,5-difluoro-2-methylbenzoyl)piperidin-2-yl]-6-methylpyrazolo[1,5-a]pyrimidin-5-yl]-4-methylpyrrolidine-3-carbonitrile;(3S,4R)-1-[2-[(2S)-1-(1H-indole-7-carbonyl)piperidin-2-yl]-6-methylpyrazolo[1,5-a]pyrimidin-5-yl]-4-methylpyrrolidine-3-carbonitrile;(3S,4R)-4-methyl-1-[6-methyl-2-[(2S)-1-[6-(trifluoromethyl)pyridine-2-carbonyl]piperidin-2-yl]pyrazolo[1,5-a]pyrimidin-5-yl]pyrrolidine-3-carbonitrile
CID 157212630

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one?
The IUPAC name of N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one (CID 159570348) is N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one?
The canonical SMILES for N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one is CC(C)c1cc(C(F)(F)F)nn1CC(=O)N(C)C.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)cn1.CC(C)c1ccc(-c2cccc3c2CC(=O)N3)nc1.CC(C)c1cnc(-c2cc[nH]c(=O)c2)nc1.CC(C)c1cnc(-c2cccc3c2CC(=O)N3)cc1C#N.CC(C)c1cnc(-c2cccc3c2CC(=O)N3C)nc1.CC(C)c1cnc(-c2ccnnc2)nc1.CC(C)c1ncc(-c2cccc3c2CC(=O)N3)cc1F.
What is the InChIKey of N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one?
The InChIKey is MHSQIXLBICKGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O.C16H15FN2O.C16H17N3O.2C16H16N2O.C12H13N3O.C11H16F3N3O.C11H12N4/c1-10(2)14-9-19-16(6-11(14)8-18)12-4-3-5-15-13(12)7-17(21)20-15;1-9(2)16-13(17)6-10(8-18-16)11-4-3-5-14-12(11)7-15(20)19-14;1-10(2)11-8-17-16(18-9-11)12-5-4-6-14-13(12)7-15(20)19(14)3;1-10(2)14-7-6-11(9-17-14)12-4-3-5-15-13(12)8-16(19)18-15;1-10(2)11-6-7-14(17-9-11)12-4-3-5-15-13(12)8-16(19)18-15;1-8(2)10-6-14-12(15-7-10)9-3-4-13-11(16)5-9;1-7(2)8-5-9(11(12,13)14)15-17(8)6-10(18)16(3)4;1-8(2)10-5-12-11(13-6-10)9-3-4-14-15-7-9/h3-6,9-10H,7H2,1-2H3,(H,20,21);3-6,8-9H,7H2,1-2H3,(H,19,20);4-6,8-10H,7H2,1-3H3;2*3-7,9-10H,8H2,1-2H3,(H,18,19);3-8H,1-2H3,(H,13,16);5,7H,6H2,1-4H3;3-8H,1-2H3.
What are the key properties of N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one?
N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one has a molecular weight of 1998.36 g/mol, XLogP of 22.39, 17 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]acetamide;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-4-(5-propan-2-ylpyrimidin-2-yl)-3H-indol-2-one;2-(2-oxo-1,3-dihydroindol-4-yl)-5-propan-2-ylpyridine-4-carbonitrile;5-propan-2-yl-2-pyridazin-4-ylpyrimidine;4-(5-propan-2-yl-2-pyridinyl)-1,3-dihydroindol-2-one;4-(6-propan-2-yl-3-pyridinyl)-1,3-dihydroindol-2-one;4-(5-propan-2-ylpyrimidin-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 159570348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).