4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine

C224H236Cl2F9N45 — CID 158018596

IUPAC4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2ccccc2c1C.Cc1[nH]nc2c(C(F)(F)F)cccc12.Cc1[nH]nc2c(C)cccc12.Cc1[nH]nc2c(Cl)cccc12.Cc1[nH]nc2ccccc12.Cc1c[nH]c2c(C#N)cccc12.Cc1c[nH]c2c(C(F)(F)F)cccc12.Cc1c[nH]c2c(C)cccc12.Cc1c[nH]c2c(C)nccc12.Cc1ccc2c(C)cn(C)c2n1.Cc1cccc2c1c(C)cn2C.Cc1cn(C)c2c(C(F)(F)F)cccc12.Cc1cn(C)c2c(C)nccc12.Cc1cn(C)c2cccc(Cl)c12.Cc1cn(C)c2cccnc12.Cc1cn(C)c2ccncc12.Cc1cn(C)c2cnccc12.Cc1cn(C)c2ncccc12.Cc1nn(C)c2ccccc12.Cc1nn(C)c2ccncc12.Cc1nn(C)c2ncccc12.Cc1nn(C)c2ncncc12.Cc1nn(C2CC2)c2ccccc12.[2H]C([2H])([2H])n1cc(C)c2ccccc21
InChIInChI=1S/C11H10F3N.C11H12N2.C11H13N.C10H10ClN.C10H8F3N.2C10H12N2.C10H8N2.3C10H11N.C9H7F3N2.7C9H10N2.C8H7ClN2.2C8H9N3.C8H8N2.C7H8N4/c1-7-6-15(2)10-8(7)4-3-5-9(10)11(12,13)14;1-8-10-4-2-3-5-11(10)13(12-8)9-6-7-9;1-8-5-4-6-10-11(8)9(2)7-12(10)3;1-7-6-12(2)9-5-3-4-8(11)10(7)9;1-6-5-14-9-7(6)3-2-4-8(9)10(11,12)13;1-7-6-12(3)10-8(2)11-5-4-9(7)10;1-7-6-12(3)10-9(7)5-4-8(2)11-10;1-7-6-12-10-8(5-11)3-2-4-9(7)10;1-7-4-3-5-9-8(2)6-11-10(7)9;1-8-7-11(2)10-6-4-3-5-9(8)10;1-7-8(2)11-10-6-4-3-5-9(7)10;1-5-6-3-2-4-7(9(10,11)12)8(6)14-13-5;1-7-6-11(2)9-3-4-10-5-8(7)9;1-7-6-11(2)9-5-10-4-3-8(7)9;1-6-5-11-9-7(2)10-4-3-8(6)9;1-7-6-11(2)8-4-3-5-10-9(7)8;1-7-6-11(2)9-8(7)4-3-5-10-9;1-7-8-5-3-4-6-9(8)11(2)10-7;1-6-4-3-5-8-7(2)10-11-9(6)8;1-5-6-3-2-4-7(9)8(6)11-10-5;1-6-7-5-9-4-3-8(7)11(2)10-6;1-6-7-4-3-5-9-8(7)11(2)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-5-6-3-8-4-9-7(6)11(2)10-5/h3-6H,1-2H3;2-5,9H,6-7H2,1H3;4-7H,1-3H3;3-6H,1-2H3;2-5,14H,1H3;2*4-6H,1-3H3;2-4,6,12H,1H3;3-6,11H,1-2H3;3-7H,1-2H3;3-6,11H,1-2H3;2-4H,1H3,(H,13,14);2*3-6H,1-2H3;3-5,11H,1-2H3;3*3-6H,1-2H3;3-5H,1-2H3,(H,10,11);2-4H,1H3,(H,10,11);2*3-5H,1-2H3;2-5H,1H3,(H,9,10);3-4H,1-2H3/i;;;;;;;;;2D3;;;;;;;;;;;;;;
InChIKeyFFUANDKMVIVXGU-RUPOIOISSA-N
MW3803.57 g/mol
LogP54.68
Rot. Bonds2

About 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine

4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine (PubChem CID 158018596) has the molecular formula C224H236Cl2F9N45 and a molecular weight of 3803.57 g/mol. Its IUPAC name is 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine
PubChem CID158018596
Molecular FormulaC224H236Cl2F9N45
Molecular Weight3803.57 g/mol
Exact Mass3799.93
IUPAC Name4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2ccccc2c1C.Cc1[nH]nc2c(C(F)(F)F)cccc12.Cc1[nH]nc2c(C)cccc12.Cc1[nH]nc2c(Cl)cccc12.Cc1[nH]nc2ccccc12.Cc1c[nH]c2c(C#N)cccc12.Cc1c[nH]c2c(C(F)(F)F)cccc12.Cc1c[nH]c2c(C)cccc12.Cc1c[nH]c2c(C)nccc12.Cc1ccc2c(C)cn(C)c2n1.Cc1cccc2c1c(C)cn2C.Cc1cn(C)c2c(C(F)(F)F)cccc12.Cc1cn(C)c2c(C)nccc12.Cc1cn(C)c2cccc(Cl)c12.Cc1cn(C)c2cccnc12.Cc1cn(C)c2ccncc12.Cc1cn(C)c2cnccc12.Cc1cn(C)c2ncccc12.Cc1nn(C)c2ccccc12.Cc1nn(C)c2ccncc12.Cc1nn(C)c2ncccc12.Cc1nn(C)c2ncncc12.Cc1nn(C2CC2)c2ccccc12.[2H]C([2H])([2H])n1cc(C)c2ccccc21
InChIInChI=1S/C11H10F3N.C11H12N2.C11H13N.C10H10ClN.C10H8F3N.2C10H12N2.C10H8N2.3C10H11N.C9H7F3N2.7C9H10N2.C8H7ClN2.2C8H9N3.C8H8N2.C7H8N4/c1-7-6-15(2)10-8(7)4-3-5-9(10)11(12,13)14;1-8-10-4-2-3-5-11(10)13(12-8)9-6-7-9;1-8-5-4-6-10-11(8)9(2)7-12(10)3;1-7-6-12(2)9-5-3-4-8(11)10(7)9;1-6-5-14-9-7(6)3-2-4-8(9)10(11,12)13;1-7-6-12(3)10-8(2)11-5-4-9(7)10;1-7-6-12(3)10-9(7)5-4-8(2)11-10;1-7-6-12-10-8(5-11)3-2-4-9(7)10;1-7-4-3-5-9-8(2)6-11-10(7)9;1-8-7-11(2)10-6-4-3-5-9(8)10;1-7-8(2)11-10-6-4-3-5-9(7)10;1-5-6-3-2-4-7(9(10,11)12)8(6)14-13-5;1-7-6-11(2)9-3-4-10-5-8(7)9;1-7-6-11(2)9-5-10-4-3-8(7)9;1-6-5-11-9-7(2)10-4-3-8(6)9;1-7-6-11(2)8-4-3-5-10-9(7)8;1-7-6-11(2)9-8(7)4-3-5-10-9;1-7-8-5-3-4-6-9(8)11(2)10-7;1-6-4-3-5-8-7(2)10-11-9(6)8;1-5-6-3-2-4-7(9)8(6)11-10-5;1-6-7-5-9-4-3-8(7)11(2)10-6;1-6-7-4-3-5-9-8(7)11(2)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-5-6-3-8-4-9-7(6)11(2)10-5/h3-6H,1-2H3;2-5,9H,6-7H2,1H3;4-7H,1-3H3;3-6H,1-2H3;2-5,14H,1H3;2*4-6H,1-3H3;2-4,6,12H,1H3;3-6,11H,1-2H3;3-7H,1-2H3;3-6,11H,1-2H3;2-4H,1H3,(H,13,14);2*3-6H,1-2H3;3-5,11H,1-2H3;3*3-6H,1-2H3;3-5H,1-2H3,(H,10,11);2-4H,1H3,(H,10,11);2*3-5H,1-2H3;2-5H,1H3,(H,9,10);3-4H,1-2H3/i;;;;;;;;;2D3;;;;;;;;;;;;;;
InChIKeyFFUANDKMVIVXGU-RUPOIOISSA-N
XLogP54.68
TPSA497.65 Ų
H-Bond Donors9
H-Bond Acceptors36
Rotatable Bonds2
Heavy Atoms280
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003803.57
LogP ≤ 554.68
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1036

Analyze 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine with MolForge

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Related Compounds

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CID 68666267
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CID 138602694
N-[6-imidazol-1-yl-3-[2-(trifluoromethyl)phenyl]-1,2,4-triazin-5-yl]-1H-indazol-3-amine;N-[6-piperidin-1-yl-3-[2-(trifluoromethyl)phenyl]-1,2,4-triazin-5-yl]-1H-indazol-3-amine;bis(N-[6-piperidin-4-yl-3-[2-(trifluoromethyl)phenyl]-1,2,4-triazin-5-yl]-1H-indazol-3-amine)
CID 157260378
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N-[2-(2-chlorophenyl)-5,6-dimethylpyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[2-(2-chlorophenyl)-6-methylpyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[5-ethyl-6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
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1-bromo-3-propan-2-ylbenzene;1-chloro-3-propan-2-ylbenzene;N,N-dimethyl-2-propan-2-ylpyrimidin-5-amine;1-fluoro-3-propan-2-ylbenzene;methane;1-methyl-4-propan-2-ylbenzimidazole;1-methyl-5-propan-2-ylbenzimidazole;1-methyl-5-propan-2-ylindazole;1-methyl-4-propan-2-ylindole;1-methyl-5-propan-2-ylindole;1-methyl-6-propan-2-ylindole;1-methyl-7-propan-2-ylindole;2-methyl-5-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-yl-1H-benzimidazole;5-propan-2-yl-1H-indazole;5-propan-2-yl-3H-indazole;6-propan-2-yl-1H-indene;7-propan-2-yl-1H-indene;4-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;6-propan-2-ylpyridin-3-amine;5-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
CID 157378604
CID 157491628
CID 157491628
5-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;4-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(6-piperazin-1-yl-3-pyridinyl)pyrimidin-2-amine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
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5-Amino-7-phenyl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carbonitrile;8-(2-chloro-6-methyl-4-pyridinyl)-7-(4-fluorophenyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(4-chlorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(4-fluorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-phenylimidazo[1,2-c]pyrimidin-5-amine
CID 157934794
N-[6-(2-chlorophenyl)-3,4-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-methyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-(4,5-dimethyl-6-phenyl-2-pyridinyl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;molecular hydrogen
CID 158111940
CID 158136776
CID 158136776

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine?
The IUPAC name of 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine (CID 158018596) is 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine is Cc1[nH]c2ccccc2c1C.Cc1[nH]nc2c(C(F)(F)F)cccc12.Cc1[nH]nc2c(C)cccc12.Cc1[nH]nc2c(Cl)cccc12.Cc1[nH]nc2ccccc12.Cc1c[nH]c2c(C#N)cccc12.Cc1c[nH]c2c(C(F)(F)F)cccc12.Cc1c[nH]c2c(C)cccc12.Cc1c[nH]c2c(C)nccc12.Cc1ccc2c(C)cn(C)c2n1.Cc1cccc2c1c(C)cn2C.Cc1cn(C)c2c(C(F)(F)F)cccc12.Cc1cn(C)c2c(C)nccc12.Cc1cn(C)c2cccc(Cl)c12.Cc1cn(C)c2cccnc12.Cc1cn(C)c2ccncc12.Cc1cn(C)c2cnccc12.Cc1cn(C)c2ncccc12.Cc1nn(C)c2ccccc12.Cc1nn(C)c2ccncc12.Cc1nn(C)c2ncccc12.Cc1nn(C)c2ncncc12.Cc1nn(C2CC2)c2ccccc12.[2H]C([2H])([2H])n1cc(C)c2ccccc21.
What is the InChIKey of 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine?
The InChIKey is FFUANDKMVIVXGU-RUPOIOISSA-N. The full InChI is InChI=1S/C11H10F3N.C11H12N2.C11H13N.C10H10ClN.C10H8F3N.2C10H12N2.C10H8N2.3C10H11N.C9H7F3N2.7C9H10N2.C8H7ClN2.2C8H9N3.C8H8N2.C7H8N4/c1-7-6-15(2)10-8(7)4-3-5-9(10)11(12,13)14;1-8-10-4-2-3-5-11(10)13(12-8)9-6-7-9;1-8-5-4-6-10-11(8)9(2)7-12(10)3;1-7-6-12(2)9-5-3-4-8(11)10(7)9;1-6-5-14-9-7(6)3-2-4-8(9)10(11,12)13;1-7-6-12(3)10-8(2)11-5-4-9(7)10;1-7-6-12(3)10-9(7)5-4-8(2)11-10;1-7-6-12-10-8(5-11)3-2-4-9(7)10;1-7-4-3-5-9-8(2)6-11-10(7)9;1-8-7-11(2)10-6-4-3-5-9(8)10;1-7-8(2)11-10-6-4-3-5-9(7)10;1-5-6-3-2-4-7(9(10,11)12)8(6)14-13-5;1-7-6-11(2)9-3-4-10-5-8(7)9;1-7-6-11(2)9-5-10-4-3-8(7)9;1-6-5-11-9-7(2)10-4-3-8(6)9;1-7-6-11(2)8-4-3-5-10-9(7)8;1-7-6-11(2)9-8(7)4-3-5-10-9;1-7-8-5-3-4-6-9(8)11(2)10-7;1-6-4-3-5-8-7(2)10-11-9(6)8;1-5-6-3-2-4-7(9)8(6)11-10-5;1-6-7-5-9-4-3-8(7)11(2)10-6;1-6-7-4-3-5-9-8(7)11(2)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-5-6-3-8-4-9-7(6)11(2)10-5/h3-6H,1-2H3;2-5,9H,6-7H2,1H3;4-7H,1-3H3;3-6H,1-2H3;2-5,14H,1H3;2*4-6H,1-3H3;2-4,6,12H,1H3;3-6,11H,1-2H3;3-7H,1-2H3;3-6,11H,1-2H3;2-4H,1H3,(H,13,14);2*3-6H,1-2H3;3-5,11H,1-2H3;3*3-6H,1-2H3;3-5H,1-2H3,(H,10,11);2-4H,1H3,(H,10,11);2*3-5H,1-2H3;2-5H,1H3,(H,9,10);3-4H,1-2H3/i;;;;;;;;;2D3;;;;;;;;;;;;;;.
What are the key properties of 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine?
4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine has a molecular weight of 3803.57 g/mol, XLogP of 54.68, 2 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1,3-dimethylindole;7-chloro-3-methyl-2H-indazole;1-cyclopropyl-3-methylindazole;1,3-dimethylindazole;3,7-dimethyl-2H-indazole;2,3-dimethyl-1H-indole;3,7-dimethyl-1H-indole;1,3-dimethylpyrazolo[5,4-b]pyridine;1,3-dimethylpyrazolo[4,5-c]pyridine;1,3-dimethylpyrazolo[3,4-d]pyrimidine;1,3-dimethylpyrrolo[2,3-b]pyridine;1,3-dimethylpyrrolo[3,2-b]pyridine;1,3-dimethylpyrrolo[2,3-c]pyridine;1,3-dimethylpyrrolo[3,2-c]pyridine;3,7-dimethyl-1H-pyrrolo[2,3-c]pyridine;1,3-dimethyl-7-(trifluoromethyl)indole;3-methyl-2H-indazole;3-methyl-1H-indole-7-carbonitrile;3-methyl-1-(trideuteriomethyl)indole;3-methyl-7-(trifluoromethyl)-2H-indazole;3-methyl-7-(trifluoromethyl)-1H-indole;1,3,4-trimethylindole;1,3,6-trimethylpyrrolo[2,3-b]pyridine;1,3,7-trimethylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 158018596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).