N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide

C139H117ClF24N32O19S — CID 163747508

IUPACN-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide
SMILESCOc1ncccc1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)cs1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)n[nH]1.Cc1cc[nH]c1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.O=C(NCc1cc(-c2ccc[nH]2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2ccc[nH]c2=O)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2cccnc2N2CCOCC2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(C2=C(Cl)CC=C2)n[nH]1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C21H20F3N5O3.C18H15F3N4O3.C17H13ClF3N3O2.C17H13F3N4O3.C17H15F3N4O2.C17H14F3N3O2S.C16H14F3N5O2.C16H13F3N4O2/c22-21(23,24)32-18-6-2-1-4-16(18)20(30)26-13-14-12-17(28-27-14)15-5-3-7-25-19(15)29-8-10-31-11-9-29;1-27-17-12(6-4-8-22-17)14-9-11(24-25-14)10-23-16(26)13-5-2-3-7-15(13)28-18(19,20)21;18-13-6-3-5-11(13)14-8-10(23-24-14)9-22-16(25)12-4-1-2-7-15(12)26-17(19,20)21;18-17(19,20)27-14-6-2-1-4-12(14)16(26)22-9-10-8-13(24-23-10)11-5-3-7-21-15(11)25;1-10-6-7-21-15(10)13-8-11(23-24-13)9-22-16(25)12-4-2-3-5-14(12)26-17(18,19)20;1-10-6-11(9-26-10)14-7-12(22-23-14)8-21-16(24)13-4-2-3-5-15(13)25-17(18,19)20;1-9-6-12(23-21-9)13-7-10(22-24-13)8-20-15(25)11-4-2-3-5-14(11)26-16(17,18)19;17-16(18,19)25-14-6-2-1-4-11(14)15(24)21-9-10-8-13(23-22-10)12-5-3-7-20-12/h1-7,12H,8-11,13H2,(H,26,30)(H,27,28);2-9H,10H2,1H3,(H,23,26)(H,24,25);1-5,7-8H,6,9H2,(H,22,25)(H,23,24);1-8H,9H2,(H,21,25)(H,22,26)(H,23,24);2-8,21H,9H2,1H3,(H,22,25)(H,23,24);2-7,9H,8H2,1H3,(H,21,24)(H,22,23);2-7H,8H2,1H3,(H,20,25)(H,21,23)(H,22,24);1-8,20H,9H2,(H,21,24)(H,22,23)
InChIKeyLNCUBQYUJZDCOS-UHFFFAOYSA-N
MW3063.14 g/mol
LogP27.17
Rot. Bonds42

About N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide

N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide (PubChem CID 163747508) has the molecular formula C139H117ClF24N32O19S and a molecular weight of 3063.14 g/mol. Its IUPAC name is N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide.

Molecular Properties

Compound NameN-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide
PubChem CID163747508
Molecular FormulaC139H117ClF24N32O19S
Molecular Weight3063.14 g/mol
Exact Mass3060.82
IUPAC NameN-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide
SMILESCOc1ncccc1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)cs1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)n[nH]1.Cc1cc[nH]c1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.O=C(NCc1cc(-c2ccc[nH]2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2ccc[nH]c2=O)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2cccnc2N2CCOCC2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(C2=C(Cl)CC=C2)n[nH]1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C21H20F3N5O3.C18H15F3N4O3.C17H13ClF3N3O2.C17H13F3N4O3.C17H15F3N4O2.C17H14F3N3O2S.C16H14F3N5O2.C16H13F3N4O2/c22-21(23,24)32-18-6-2-1-4-16(18)20(30)26-13-14-12-17(28-27-14)15-5-3-7-25-19(15)29-8-10-31-11-9-29;1-27-17-12(6-4-8-22-17)14-9-11(24-25-14)10-23-16(26)13-5-2-3-7-15(13)28-18(19,20)21;18-13-6-3-5-11(13)14-8-10(23-24-14)9-22-16(25)12-4-1-2-7-15(12)26-17(19,20)21;18-17(19,20)27-14-6-2-1-4-12(14)16(26)22-9-10-8-13(24-23-10)11-5-3-7-21-15(11)25;1-10-6-7-21-15(10)13-8-11(23-24-13)9-22-16(25)12-4-2-3-5-14(12)26-17(18,19)20;1-10-6-11(9-26-10)14-7-12(22-23-14)8-21-16(24)13-4-2-3-5-15(13)25-17(18,19)20;1-9-6-12(23-21-9)13-7-10(22-24-13)8-20-15(25)11-4-2-3-5-14(11)26-16(17,18)19;17-16(18,19)25-14-6-2-1-4-11(14)15(24)21-9-10-8-13(23-22-10)12-5-3-7-20-12/h1-7,12H,8-11,13H2,(H,26,30)(H,27,28);2-9H,10H2,1H3,(H,23,26)(H,24,25);1-5,7-8H,6,9H2,(H,22,25)(H,23,24);1-8H,9H2,(H,21,25)(H,22,26)(H,23,24);2-8,21H,9H2,1H3,(H,22,25)(H,23,24);2-7,9H,8H2,1H3,(H,21,24)(H,22,23);2-7H,8H2,1H3,(H,20,25)(H,21,23)(H,22,24);1-8,20H,9H2,(H,21,24)(H,22,23)
InChIKeyLNCUBQYUJZDCOS-UHFFFAOYSA-N
XLogP27.17
TPSA676.68 Ų
H-Bond Donors20
H-Bond Acceptors32
Rotatable Bonds42
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003063.14
LogP ≤ 527.17
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1032

Analyze N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide with MolForge

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Related Compounds

1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;3-(2-methoxy-3-methylphenyl)-5-methyl-1H-pyrazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-6-methylpyridine;2-(2-methoxy-3-methylphenyl)pyrazine;1-[4-(2-methoxy-3-methylphenyl)pyrazol-1-yl]-2-methylpropan-2-ol;3-(2-methoxy-3-methylphenyl)pyridazine;2-(2-methoxy-3-methylphenyl)pyridine;5-(2-methoxy-3-methylphenyl)-1,3-thiazole;4-(2-methoxy-3-methylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 157821643
N-(1,3-diphenylpyrazol-5-yl)benzamide;N-(1,3-diphenylpyrazol-5-yl)-4-fluorobenzamide;N-(1,3-diphenylpyrazol-5-yl)-2-methoxybenzamide;N-(1,3-diphenylpyrazol-5-yl)pyridine-2-carboxamide;N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-4-(trifluoromethyl)benzamide
CID 158105872
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;methane;1-[4-(2-methoxy-3-methylphenyl)-2H-imidazol-2-yl]-2-methylpropan-2-ol;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;3-(2-methoxy-3-methylphenyl)-5-methyl-1H-pyrazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;2-(2-methoxy-3-methylphenyl)pyrazine;3-(2-methoxy-3-methylphenyl)pyridazine;2-(2-methoxy-3-methylphenyl)pyridine;5-(2-methoxy-3-methylphenyl)-1,3-thiazole;4-(2-methoxy-3-methylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 159822905
N-[4-[chloro(difluoro)methoxy]phenyl]-6-[ethyl(2-hydroxyethyl)amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[[(2S)-2-hydroxypentyl]amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[[(2R)-2-hydroxypentyl]amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-(2-hydroxypentylamino)-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[[(3S)-3-hydroxypentyl]amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[[(3R)-3-hydroxypentyl]amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-(3-hydroxypentylamino)-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-(1H-pyrazol-5-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]pyridine-3-carboxamide
CID 161483786
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;methane;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;3-(2-methoxy-3-methylphenyl)-5-methyl-1H-pyrazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;2-(2-methoxy-3-methylphenyl)pyrazine;1-[4-(2-methoxy-3-methylphenyl)pyrazol-1-yl]-2-methylpropan-2-ol;3-(2-methoxy-3-methylphenyl)pyridazine;2-(2-methoxy-3-methylphenyl)pyridine;5-(2-methoxy-3-methylphenyl)-1,3-thiazole;4-(2-methoxy-3-methylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 161719539
N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[1-[[4-(3-methylthiophen-2-yl)phenyl]methylamino]ethenyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 161208216
2,6-difluoro-N-[5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]-3-methylthiophene-2-carboxamide;N-[5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]-3-methylthiophene-2-carboxamide
CID 158147163
N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-[[3-[[(2S)-3,3-dimethyl-1-[(2S,4R)-4-methyl-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-1-oxobutan-2-yl]amino]-3-oxopropoxy]methyl]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[4-[[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]methyl]piperidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[1-[[4-(3-methylthiophen-2-yl)phenyl]methylamino]ethenyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;methane
CID 161208215
N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-[[3-[[(2S)-3,3-dimethyl-1-[(2S,4R)-4-methyl-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-1-oxobutan-2-yl]amino]-3-oxopropoxy]methyl]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[1-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylamino]ethenyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]pyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-6-[4-[[3-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-3-oxopropoxy]methyl]piperidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 161412500

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide?
The IUPAC name of N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide (CID 163747508) is N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide.
What is the SMILES notation for N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide?
The canonical SMILES for N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide is COc1ncccc1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)cs1.Cc1cc(-c2cc(CNC(=O)c3ccccc3OC(F)(F)F)[nH]n2)n[nH]1.Cc1cc[nH]c1-c1cc(CNC(=O)c2ccccc2OC(F)(F)F)[nH]n1.O=C(NCc1cc(-c2ccc[nH]2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2ccc[nH]c2=O)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(-c2cccnc2N2CCOCC2)n[nH]1)c1ccccc1OC(F)(F)F.O=C(NCc1cc(C2=C(Cl)CC=C2)n[nH]1)c1ccccc1OC(F)(F)F.
What is the InChIKey of N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide?
The InChIKey is LNCUBQYUJZDCOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20F3N5O3.C18H15F3N4O3.C17H13ClF3N3O2.C17H13F3N4O3.C17H15F3N4O2.C17H14F3N3O2S.C16H14F3N5O2.C16H13F3N4O2/c22-21(23,24)32-18-6-2-1-4-16(18)20(30)26-13-14-12-17(28-27-14)15-5-3-7-25-19(15)29-8-10-31-11-9-29;1-27-17-12(6-4-8-22-17)14-9-11(24-25-14)10-23-16(26)13-5-2-3-7-15(13)28-18(19,20)21;18-13-6-3-5-11(13)14-8-10(23-24-14)9-22-16(25)12-4-1-2-7-15(12)26-17(19,20)21;18-17(19,20)27-14-6-2-1-4-12(14)16(26)22-9-10-8-13(24-23-10)11-5-3-7-21-15(11)25;1-10-6-7-21-15(10)13-8-11(23-24-13)9-22-16(25)12-4-2-3-5-14(12)26-17(18,19)20;1-10-6-11(9-26-10)14-7-12(22-23-14)8-21-16(24)13-4-2-3-5-15(13)25-17(18,19)20;1-9-6-12(23-21-9)13-7-10(22-24-13)8-20-15(25)11-4-2-3-5-14(11)26-16(17,18)19;17-16(18,19)25-14-6-2-1-4-11(14)15(24)21-9-10-8-13(23-22-10)12-5-3-7-20-12/h1-7,12H,8-11,13H2,(H,26,30)(H,27,28);2-9H,10H2,1H3,(H,23,26)(H,24,25);1-5,7-8H,6,9H2,(H,22,25)(H,23,24);1-8H,9H2,(H,21,25)(H,22,26)(H,23,24);2-8,21H,9H2,1H3,(H,22,25)(H,23,24);2-7,9H,8H2,1H3,(H,21,24)(H,22,23);2-7H,8H2,1H3,(H,20,25)(H,21,23)(H,22,24);1-8,20H,9H2,(H,21,24)(H,22,23).
What are the key properties of N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide?
N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide has a molecular weight of 3063.14 g/mol, XLogP of 27.17, 42 rotatable bonds, 20 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-chlorocyclopenta-1,4-dien-1-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-methoxy-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(3-methyl-1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(5-methylthiophen-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-morpholin-4-yl-3-pyridinyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(2-oxo-1H-pyridin-3-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide;N-[[3-(1H-pyrrol-2-yl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide is sourced from PubChem (CID 163747508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).