1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one

C150H211F2N29O18S — CID 159399343

IUPAC1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
SMILESCC(C)C(=O)Cc1ccccn1.CC(C)C(=O)c1[nH]ccc1F.CC(C)C(=O)c1cccnc1.CC(C)C(=O)c1ccnc(C(C)C)n1.CC(C)C(=O)c1cn(C)cn1.CC(C)C(=O)c1cncn1C.CC(C)C(=O)c1cnn(C(C)C)c1.CC(C)C(=O)c1cnnn1-c1ccccc1.CC(C)C(=O)c1csc(C(C)C)n1.CC(C)C(=O)c1ncccc1F.CC(C)C(=O)c1nccn1C.CC1=NCC(C(=O)C(C)C)=N1.CCOC(=O)Cn1cc(C(=O)C(C)C)nn1.Cc1cc(C(=O)C(C)C)nc(C)n1.Cc1nn(C)c(C)c1C(=O)C(C)C.Cc1nn(C)cc1C(=O)C(C)C
InChIInChI=1S/C12H13N3O.C11H16N2O.C10H15N3O3.2C10H16N2O.C10H14N2O.C10H15NOS.C10H13NO.C9H10FNO.C9H14N2O.C9H11NO.C8H10FNO.4C8H12N2O/c1-9(2)12(16)11-8-13-14-15(11)10-6-4-3-5-7-10;1-7(2)10(14)9-5-6-12-11(13-9)8(3)4;1-4-16-9(14)6-13-5-8(11-12-13)10(15)7(2)3;1-7(2)10(13)9-5-11-12(6-9)8(3)4;1-6(2)10(13)9-7(3)11-12(5)8(9)4;1-6(2)10(13)9-5-7(3)11-8(4)12-9;1-6(2)9(12)8-5-13-10(11-8)7(3)4;1-8(2)10(12)7-9-5-3-4-6-11-9;1-6(2)9(12)8-7(10)4-3-5-11-8;1-6(2)9(12)8-5-11(4)10-7(8)3;1-7(2)9(11)8-4-3-5-10-6-8;1-5(2)8(11)7-6(9)3-4-10-7;1-6(2)8(11)7-4-10(3)5-9-7;1-6(2)8(11)7-4-9-5-10(7)3;1-6(2)7(11)8-9-4-5-10(8)3;1-5(2)8(11)7-4-9-6(3)10-7/h3-9H,1-2H3;5-8H,1-4H3;5,7H,4,6H2,1-3H3;5-8H,1-4H3;6H,1-5H3;5-6H,1-4H3;5-7H,1-4H3;3-6,8H,7H2,1-2H3;3-6H,1-2H3;5-6H,1-4H3;3-7H,1-2H3;3-5,10H,1-2H3;3*4-6H,1-3H3;5H,4H2,1-3H3
InChIKeyLNDHHCJITQWCMM-UHFFFAOYSA-N
MW2778.59 g/mol
LogP28.69
Rot. Bonds40

About 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one

1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one (PubChem CID 159399343) has the molecular formula C150H211F2N29O18S and a molecular weight of 2778.59 g/mol. Its IUPAC name is 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one.

Molecular Properties

Compound Name1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
PubChem CID159399343
Molecular FormulaC150H211F2N29O18S
Molecular Weight2778.59 g/mol
Exact Mass2776.62
IUPAC Name1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
SMILESCC(C)C(=O)Cc1ccccn1.CC(C)C(=O)c1[nH]ccc1F.CC(C)C(=O)c1cccnc1.CC(C)C(=O)c1ccnc(C(C)C)n1.CC(C)C(=O)c1cn(C)cn1.CC(C)C(=O)c1cncn1C.CC(C)C(=O)c1cnn(C(C)C)c1.CC(C)C(=O)c1cnnn1-c1ccccc1.CC(C)C(=O)c1csc(C(C)C)n1.CC(C)C(=O)c1ncccc1F.CC(C)C(=O)c1nccn1C.CC1=NCC(C(=O)C(C)C)=N1.CCOC(=O)Cn1cc(C(=O)C(C)C)nn1.Cc1cc(C(=O)C(C)C)nc(C)n1.Cc1nn(C)c(C)c1C(=O)C(C)C.Cc1nn(C)cc1C(=O)C(C)C
InChIInChI=1S/C12H13N3O.C11H16N2O.C10H15N3O3.2C10H16N2O.C10H14N2O.C10H15NOS.C10H13NO.C9H10FNO.C9H14N2O.C9H11NO.C8H10FNO.4C8H12N2O/c1-9(2)12(16)11-8-13-14-15(11)10-6-4-3-5-7-10;1-7(2)10(14)9-5-6-12-11(13-9)8(3)4;1-4-16-9(14)6-13-5-8(11-12-13)10(15)7(2)3;1-7(2)10(13)9-5-11-12(6-9)8(3)4;1-6(2)10(13)9-7(3)11-12(5)8(9)4;1-6(2)10(13)9-5-7(3)11-8(4)12-9;1-6(2)9(12)8-5-13-10(11-8)7(3)4;1-8(2)10(12)7-9-5-3-4-6-11-9;1-6(2)9(12)8-7(10)4-3-5-11-8;1-6(2)9(12)8-5-11(4)10-7(8)3;1-7(2)9(11)8-4-3-5-10-6-8;1-5(2)8(11)7-6(9)3-4-10-7;1-6(2)8(11)7-4-10(3)5-9-7;1-6(2)8(11)7-4-9-5-10(7)3;1-6(2)7(11)8-9-4-5-10(8)3;1-5(2)8(11)7-4-9-6(3)10-7/h3-9H,1-2H3;5-8H,1-4H3;5,7H,4,6H2,1-3H3;5-8H,1-4H3;6H,1-5H3;5-6H,1-4H3;5-7H,1-4H3;3-6,8H,7H2,1-2H3;3-6H,1-2H3;5-6H,1-4H3;3-7H,1-2H3;3-5,10H,1-2H3;3*4-6H,1-3H3;5H,4H2,1-3H3
InChIKeyLNDHHCJITQWCMM-UHFFFAOYSA-N
XLogP28.69
TPSA611.39 Ų
H-Bond Donors1
H-Bond Acceptors47
Rotatable Bonds40
Heavy Atoms200
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002778.59
LogP ≤ 528.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1047

Analyze 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(benzylamino)-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;tert-butyl 4-[[5-(6-ethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]carbamoyl]piperidine-1-carboxylate;2-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-phenylbenzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 157066875
1-[2-[1-[2-(4-fluorophenyl)ethyl]triazol-4-yl]-4-methyl-1,3-thiazol-5-yl]-3-pyridin-3-ylpropan-1-one;3-[(4-fluorophenyl)methyl]-1-[5-methyl-4-(3-phenylpropanoyl)-1H-imidazol-2-yl]piperidin-2-one;3-[(4-fluorophenyl)methyl]-1-[4-methyl-5-(3-pyridin-3-ylpropanoyl)-1,3-thiazol-2-yl]pyrrolidin-2-one;3-(4-fluorophenyl)-1-[1-[4-methyl-5-(3-phenylpropanoyl)-1,3-thiazol-2-yl]triazol-4-yl]propan-1-one;1-[4-methyl-2-[1-[2-(N-methylanilino)ethyl]pyrazol-3-yl]-1,3-thiazol-5-yl]-3-pyridin-3-ylpropan-1-one;1-[4-methyl-2-[6-(2-phenylethyl)pyrazin-2-yl]-1,3-thiazol-5-yl]-3-phenylpropan-1-one;1-[4-methyl-5-(3-pyridin-3-ylpropanoyl)-1,3-thiazol-2-yl]-3-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-one
CID 157491500
1-[4-[4-(Difluoromethyl)-5-methyl-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(6-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 158029613
1-[4-[4-(Difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-[2-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazol-5-yl]ethanone;2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(1-methylimidazol-4-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(5-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 158442581
3-anilino-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]pyridine-2-carboxamide;2-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-phenylbenzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-(2-phenylethyl)benzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 158570745
8-amino-2-methyl-1,7-dihydropurin-6-one;8-amino-3H-pyrido[3,4-d]pyrimidin-4-one;2-amino-6H-[1,3]thiazolo[4,5-d]pyrimidin-7-one;5-amino-6H-[1,3]thiazolo[4,5-d]pyrimidin-7-one;2-amino-7-(trifluoromethyl)-3H-imidazo[5,1-f][1,2,4]triazin-4-one;1-tert-butyl-2,5-dimethylpyrido[2,3-d]pyrimidin-4-one;3-tert-butylimidazo[4,5-b]pyrazin-2-amine;1-tert-butyl-2-methylpyrido[2,3-d]pyrimidin-4-one;2-tert-butyl-5-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-one;7-tert-butylpurin-8-amine;2,8-dimethyl-1,7-dihydropurin-6-one;2,5-dimethyl-3,7-dihydropyrrolo[3,2-d]pyrimidine-4,6-dione;2,7-dimethyl-1H-purin-6-one;3-methyl-7,7a-dihydro-3aH-imidazo[4,5-c]pyridine-4,6-dione;1-methyl-6H-[1,3]oxazolo[5,4-d]pyrimidine-2,7-dione;tridecakis(2-methylpropane);3-methyl-5H-triazolo[4,5-c]pyridin-4-one;1-methyl-6H-triazolo[4,5-d]pyridazin-7-one;3,5,6,8-tetrahydroquinazoline-4,7-dione
CID 159305573
1-[4-[4-(Difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-[2-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazol-5-yl]ethanone;2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(4-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(5-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 160162045
1-[4-[4-(Difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(4-methylpyrimidin-2-yl)pyrazol-5-yl]ethanone;2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(4-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(5-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 161165312
1-[4-[4-(Difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(5-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 161574622
1-[4-[4-(Difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]ethanone;2-[2-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazol-5-yl]ethanone;2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone;1-[1-methyl-4-(1-methylimidazol-4-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 161649104
1-[4-(4-Tert-butyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(4-methylpyrimidin-2-yl)pyrazol-5-yl]ethanone;1-[1-methyl-4-(4-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(1,3-thiazol-2-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(1,3-thiazol-4-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 157129907
1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(5-methyl-1H-imidazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
CID 157203760

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one?
The IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one (CID 159399343) is 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one.
What is the SMILES notation for 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one?
The canonical SMILES for 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one is CC(C)C(=O)Cc1ccccn1.CC(C)C(=O)c1[nH]ccc1F.CC(C)C(=O)c1cccnc1.CC(C)C(=O)c1ccnc(C(C)C)n1.CC(C)C(=O)c1cn(C)cn1.CC(C)C(=O)c1cncn1C.CC(C)C(=O)c1cnn(C(C)C)c1.CC(C)C(=O)c1cnnn1-c1ccccc1.CC(C)C(=O)c1csc(C(C)C)n1.CC(C)C(=O)c1ncccc1F.CC(C)C(=O)c1nccn1C.CC1=NCC(C(=O)C(C)C)=N1.CCOC(=O)Cn1cc(C(=O)C(C)C)nn1.Cc1cc(C(=O)C(C)C)nc(C)n1.Cc1nn(C)c(C)c1C(=O)C(C)C.Cc1nn(C)cc1C(=O)C(C)C.
What is the InChIKey of 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one?
The InChIKey is LNDHHCJITQWCMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O.C11H16N2O.C10H15N3O3.2C10H16N2O.C10H14N2O.C10H15NOS.C10H13NO.C9H10FNO.C9H14N2O.C9H11NO.C8H10FNO.4C8H12N2O/c1-9(2)12(16)11-8-13-14-15(11)10-6-4-3-5-7-10;1-7(2)10(14)9-5-6-12-11(13-9)8(3)4;1-4-16-9(14)6-13-5-8(11-12-13)10(15)7(2)3;1-7(2)10(13)9-5-11-12(6-9)8(3)4;1-6(2)10(13)9-7(3)11-12(5)8(9)4;1-6(2)10(13)9-5-7(3)11-8(4)12-9;1-6(2)9(12)8-5-13-10(11-8)7(3)4;1-8(2)10(12)7-9-5-3-4-6-11-9;1-6(2)9(12)8-7(10)4-3-5-11-8;1-6(2)9(12)8-5-11(4)10-7(8)3;1-7(2)9(11)8-4-3-5-10-6-8;1-5(2)8(11)7-6(9)3-4-10-7;1-6(2)8(11)7-4-10(3)5-9-7;1-6(2)8(11)7-4-9-5-10(7)3;1-6(2)7(11)8-9-4-5-10(8)3;1-5(2)8(11)7-4-9-6(3)10-7/h3-9H,1-2H3;5-8H,1-4H3;5,7H,4,6H2,1-3H3;5-8H,1-4H3;6H,1-5H3;5-6H,1-4H3;5-7H,1-4H3;3-6,8H,7H2,1-2H3;3-6H,1-2H3;5-6H,1-4H3;3-7H,1-2H3;3-5,10H,1-2H3;3*4-6H,1-3H3;5H,4H2,1-3H3.
What are the key properties of 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one?
1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one has a molecular weight of 2778.59 g/mol, XLogP of 28.69, 40 rotatable bonds, 1 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(2,6-dimethylpyrimidin-4-yl)-2-methylpropan-1-one;ethyl 2-[4-(2-methylpropanoyl)triazol-1-yl]acetate;1-(3-fluoro-2-pyridinyl)-2-methylpropan-1-one;1-(3-fluoro-1H-pyrrol-2-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-2-yl)propan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(2-methyl-4H-imidazol-5-yl)propan-1-one;2-methyl-1-(3-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-phenyltriazol-4-yl)propan-1-one;2-methyl-1-(1-propan-2-ylpyrazol-4-yl)propan-1-one;2-methyl-1-(2-propan-2-ylpyrimidin-4-yl)propan-1-one;2-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one;3-methyl-1-pyridin-2-ylbutan-2-one;2-methyl-1-pyridin-3-ylpropan-1-one;2-methyl-1-(1,3,5-trimethylpyrazol-4-yl)propan-1-one is sourced from PubChem (CID 159399343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).