1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole

C183H204F9N25O18S3 — CID 159021626

IUPAC1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
SMILESCOc1c(C)cccc1-c1ccccn1.COc1c(C)cccc1-c1cn[nH]c1.COc1c(C)cccc1-c1cnc(C)s1.COc1c(C)cccc1-c1cnccn1.COc1c(C)cccc1-c1cncs1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(CC(F)(F)F)c1.COc1c(C)cccc1-c1cnn(CC(F)F)c1.COc1c(C)cccc1-c1cnn(CCF)c1.COc1c(C)cccc1-c1ncc(C)[nH]1.COc1c(C)cccc1-c1nccc(C)n1.COc1c(C)cccc1C(=O)NCC(F)(F)F.COc1c(C)cccc1C(=O)NCCC(C)(C)O.CSc1c(C)cccc1-c1nnc(C)o1
InChIInChI=1S/C14H21NO3.C13H13F3N2O.C13H14F2N2O.C13H15FN2O.C13H14N2O.C13H13NO.3C12H14N2O.C12H12N2O.C12H13NOS.C11H12F3NO2.C11H12N2OS.C11H12N2O.C11H11NOS/c1-10-6-5-7-11(12(10)18-4)13(16)15-9-8-14(2,3)17;1-9-4-3-5-11(12(9)19-2)10-6-17-18(7-10)8-13(14,15)16;1-9-4-3-5-11(13(9)18-2)10-6-16-17(7-10)8-12(14)15;1-10-4-3-5-12(13(10)17-2)11-8-15-16(9-11)7-6-14;1-9-5-4-6-11(12(9)16-3)13-14-8-7-10(2)15-13;1-10-6-5-7-11(13(10)15-2)12-8-3-4-9-14-12;2*1-9-5-4-6-11(12(9)15-3)10-7-13-14(2)8-10;1-8-5-4-6-10(11(8)15-3)12-13-7-9(2)14-12;1-9-4-3-5-10(12(9)15-2)11-8-13-6-7-14-11;1-8-5-4-6-10(12(8)14-3)11-7-13-9(2)15-11;1-7-4-3-5-8(9(7)17-2)10(16)15-6-11(12,13)14;1-7-5-4-6-9(10(7)15-3)11-13-12-8(2)14-11;1-8-4-3-5-10(11(8)14-2)9-6-12-13-7-9;1-8-4-3-5-9(11(8)13-2)10-6-12-7-14-10/h5-7,17H,8-9H2,1-4H3,(H,15,16);3-7H,8H2,1-2H3;3-7,12H,8H2,1-2H3;3-5,8-9H,6-7H2,1-2H3;4-8H,1-3H3;3-9H,1-2H3;2*4-8H,1-3H3;4-7H,1-3H3,(H,13,14);3-8H,1-2H3;4-7H,1-3H3;3-5H,6H2,1-2H3,(H,15,16);4-6H,1-3H3;3-7H,1-2H3,(H,12,13);3-7H,1-2H3
InChIKeyJTTSJUSRZLXGQW-UHFFFAOYSA-N
MW3308.98 g/mol
LogP41.43
Rot. Bonds39

About 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole

1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole (PubChem CID 159021626) has the molecular formula C183H204F9N25O18S3 and a molecular weight of 3308.98 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
PubChem CID159021626
Molecular FormulaC183H204F9N25O18S3
Molecular Weight3308.98 g/mol
Exact Mass3306.48
IUPAC Name1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
SMILESCOc1c(C)cccc1-c1ccccn1.COc1c(C)cccc1-c1cn[nH]c1.COc1c(C)cccc1-c1cnc(C)s1.COc1c(C)cccc1-c1cnccn1.COc1c(C)cccc1-c1cncs1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(CC(F)(F)F)c1.COc1c(C)cccc1-c1cnn(CC(F)F)c1.COc1c(C)cccc1-c1cnn(CCF)c1.COc1c(C)cccc1-c1ncc(C)[nH]1.COc1c(C)cccc1-c1nccc(C)n1.COc1c(C)cccc1C(=O)NCC(F)(F)F.COc1c(C)cccc1C(=O)NCCC(C)(C)O.CSc1c(C)cccc1-c1nnc(C)o1
InChIInChI=1S/C14H21NO3.C13H13F3N2O.C13H14F2N2O.C13H15FN2O.C13H14N2O.C13H13NO.3C12H14N2O.C12H12N2O.C12H13NOS.C11H12F3NO2.C11H12N2OS.C11H12N2O.C11H11NOS/c1-10-6-5-7-11(12(10)18-4)13(16)15-9-8-14(2,3)17;1-9-4-3-5-11(12(9)19-2)10-6-17-18(7-10)8-13(14,15)16;1-9-4-3-5-11(13(9)18-2)10-6-16-17(7-10)8-12(14)15;1-10-4-3-5-12(13(10)17-2)11-8-15-16(9-11)7-6-14;1-9-5-4-6-11(12(9)16-3)13-14-8-7-10(2)15-13;1-10-6-5-7-11(13(10)15-2)12-8-3-4-9-14-12;2*1-9-5-4-6-11(12(9)15-3)10-7-13-14(2)8-10;1-8-5-4-6-10(11(8)15-3)12-13-7-9(2)14-12;1-9-4-3-5-10(12(9)15-2)11-8-13-6-7-14-11;1-8-5-4-6-10(12(8)14-3)11-7-13-9(2)15-11;1-7-4-3-5-8(9(7)17-2)10(16)15-6-11(12,13)14;1-7-5-4-6-9(10(7)15-3)11-13-12-8(2)14-11;1-8-4-3-5-10(11(8)14-2)9-6-12-13-7-9;1-8-4-3-5-9(11(8)13-2)10-6-12-7-14-10/h5-7,17H,8-9H2,1-4H3,(H,15,16);3-7H,8H2,1-2H3;3-7,12H,8H2,1-2H3;3-5,8-9H,6-7H2,1-2H3;4-8H,1-3H3;3-9H,1-2H3;2*4-8H,1-3H3;4-7H,1-3H3,(H,13,14);3-8H,1-2H3;4-7H,1-3H3;3-5H,6H2,1-2H3,(H,15,16);4-6H,1-3H3;3-7H,1-2H3,(H,12,13);3-7H,1-2H3
InChIKeyJTTSJUSRZLXGQW-UHFFFAOYSA-N
XLogP41.43
TPSA483.26 Ų
H-Bond Donors5
H-Bond Acceptors42
Rotatable Bonds39
Heavy Atoms238
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003308.98
LogP ≤ 541.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1042

Analyze 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole 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
CID 158268952
CID 158268952
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);5-(2-methoxy-3-methylphenyl)-1,3-thiazole;4-(2-methoxy-3-methylphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 158385074
N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(1-benzothiophen-3-yl)-2-pyridinyl]-2-methoxybenzamide;N-[6-amino-5-(1-methylindol-2-yl)-2-pyridinyl]-2-methoxybenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-ethylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-2-pyridinyl]-4-methylbenzamide
CID 159417614
2,5-dimethylfuran;1,4-dimethylpyrazole;1,2-dimethylpyrrole;2,5-dimethylthiophene;ethane;2-ethyl-1-methylpyrrole;(3R)-3-fluoro-1-methylpyrrolidine;(3S)-3-fluoro-1-methylpyrrolidine;1-methoxybut-2-ene;2-methyl-1-benzofuran;2-methylcyclopenta-1,3-diene;methylcyclopentane;1-methylcyclopentene;methylcyclopropane;5-methyl-2,3-dihydro-1-benzofuran;4-methyl-3,6-dihydro-2H-pyran;1-methylimidazole;2-methyl-1H-indole;(3-methylphenyl)-pyrrolidin-1-ylmethanone;1-methylpyrazole;5-methyl-1H-pyrazole;2-methylpyridine;3-methylpyridine;6-methyl-1H-pyridin-2-one;1-methylpyrrole;2-methyl-1H-pyrrole;1-methylpyrrolidine;1-methylpyrrolidin-3-ol;(3S)-1-methylpyrrolidin-3-ol;(3R)-1-methylpyrrolidin-3-ol;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;4-methyl-2-(trifluoromethyl)pyridine;5-methyl-2-(trifluoromethyl)pyridine;1,2,5-trimethylpyrrole
CID 159645627
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;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;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
CID 159793171
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
1-ethynyl-2-methoxy-3-methylbenzene;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;3-(2-methoxy-3-methylphenyl)-6-methylpyridazine;5-(2-methoxy-3-methylphenyl)-1-methyltetrazole;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;5-(2-methoxy-3-methylphenyl)-1-methyl-1,2,4-triazole;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;1-[3-(2-methoxy-3-methylphenyl)pyrazol-1-yl]-2-methylpropan-2-ol;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
CID 159918552
1-ethynyl-2-methoxy-3-methylbenzene;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;2-methoxy-N-(2-methoxyethyl)-3-methylbenzamide;5-(2-methoxy-3-methylphenyl)-2,4-dimethyl-1,3-thiazole;3-(2-methoxy-3-methylphenyl)-6-methylpyridazine;5-(2-methoxy-3-methylphenyl)-1-methyltetrazole;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;5-(2-methoxy-3-methylphenyl)-1-methyl-1,2,4-triazole;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;1-[3-(2-methoxy-3-methylphenyl)pyrazol-1-yl]-2-methylpropan-2-ol;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole
CID 160708253
N-[6-amino-5-(1-benzothiophen-3-yl)-2-pyridinyl]-2-hydroxybenzamide;N-[6-amino-5-(1-benzothiophen-3-yl)-2-pyridinyl]-2-methoxybenzamide;N-[6-amino-5-(1-methylindol-2-yl)-2-pyridinyl]-2-hydroxybenzamide;N-[6-amino-5-(1-methylindol-2-yl)-2-pyridinyl]-2-methoxybenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-ethylbenzamide;N-[6-amino-5-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-2-pyridinyl]-4-methylbenzamide
CID 160811987
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;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 161608744
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

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole?
The IUPAC name of 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole (CID 159021626) is 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole.
What is the SMILES notation for 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole?
The canonical SMILES for 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole is COc1c(C)cccc1-c1ccccn1.COc1c(C)cccc1-c1cn[nH]c1.COc1c(C)cccc1-c1cnc(C)s1.COc1c(C)cccc1-c1cnccn1.COc1c(C)cccc1-c1cncs1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(C)c1.COc1c(C)cccc1-c1cnn(CC(F)(F)F)c1.COc1c(C)cccc1-c1cnn(CC(F)F)c1.COc1c(C)cccc1-c1cnn(CCF)c1.COc1c(C)cccc1-c1ncc(C)[nH]1.COc1c(C)cccc1-c1nccc(C)n1.COc1c(C)cccc1C(=O)NCC(F)(F)F.COc1c(C)cccc1C(=O)NCCC(C)(C)O.CSc1c(C)cccc1-c1nnc(C)o1.
What is the InChIKey of 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole?
The InChIKey is JTTSJUSRZLXGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3.C13H13F3N2O.C13H14F2N2O.C13H15FN2O.C13H14N2O.C13H13NO.3C12H14N2O.C12H12N2O.C12H13NOS.C11H12F3NO2.C11H12N2OS.C11H12N2O.C11H11NOS/c1-10-6-5-7-11(12(10)18-4)13(16)15-9-8-14(2,3)17;1-9-4-3-5-11(12(9)19-2)10-6-17-18(7-10)8-13(14,15)16;1-9-4-3-5-11(13(9)18-2)10-6-16-17(7-10)8-12(14)15;1-10-4-3-5-12(13(10)17-2)11-8-15-16(9-11)7-6-14;1-9-5-4-6-11(12(9)16-3)13-14-8-7-10(2)15-13;1-10-6-5-7-11(13(10)15-2)12-8-3-4-9-14-12;2*1-9-5-4-6-11(12(9)15-3)10-7-13-14(2)8-10;1-8-5-4-6-10(11(8)15-3)12-13-7-9(2)14-12;1-9-4-3-5-10(12(9)15-2)11-8-13-6-7-14-11;1-8-5-4-6-10(12(8)14-3)11-7-13-9(2)15-11;1-7-4-3-5-8(9(7)17-2)10(16)15-6-11(12,13)14;1-7-5-4-6-9(10(7)15-3)11-13-12-8(2)14-11;1-8-4-3-5-10(11(8)14-2)9-6-12-13-7-9;1-8-4-3-5-9(11(8)13-2)10-6-12-7-14-10/h5-7,17H,8-9H2,1-4H3,(H,15,16);3-7H,8H2,1-2H3;3-7,12H,8H2,1-2H3;3-5,8-9H,6-7H2,1-2H3;4-8H,1-3H3;3-9H,1-2H3;2*4-8H,1-3H3;4-7H,1-3H3,(H,13,14);3-8H,1-2H3;4-7H,1-3H3;3-5H,6H2,1-2H3,(H,15,16);4-6H,1-3H3;3-7H,1-2H3,(H,12,13);3-7H,1-2H3.
What are the key properties of 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole?
1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole has a molecular weight of 3308.98 g/mol, XLogP of 41.43, 39 rotatable bonds, 5 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;1-(2-fluoroethyl)-4-(2-methoxy-3-methylphenyl)pyrazole;N-(3-hydroxy-3-methylbutyl)-2-methoxy-3-methylbenzamide;2-(2-methoxy-3-methylphenyl)-5-methyl-1H-imidazole;bis(4-(2-methoxy-3-methylphenyl)-1-methylpyrazole);2-(2-methoxy-3-methylphenyl)-4-methylpyrimidine;5-(2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole;2-(2-methoxy-3-methylphenyl)pyrazine;4-(2-methoxy-3-methylphenyl)-1H-pyrazole;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;2-methoxy-3-methyl-N-(2,2,2-trifluoroethyl)benzamide;2-methyl-5-(3-methyl-2-methylsulfanylphenyl)-1,3,4-oxadiazole is sourced from PubChem (CID 159021626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).