methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine

C190H243N49S6 — CID 158721554

IUPACmethane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CN1C=CC2=NCNC2=C1.CN1CNc2ncccc21.Cc1cccc2[nH]ccc12.Cc1ccnc2ccccc12.Cc1ccnc2sccc12.Cc1cnc2ccccc2c1.Cc1csc(-c2ccccn2)n1.Cc1csc(-c2ccncc2)n1.Cc1nc(-c2cccnc2)cs1.Cc1nc2ccccc2s1.Cc1nc2ccncc2[nH]1.Cc1nc2ncccc2[nH]1.Cc1nnc(-c2cccnc2)s1.Cn1cnc(-c2ccccc2)c1.Cn1cnc(-c2ccccc2)n1.Cn1cnc2ccccc21.Cn1cnc2ccccc21.Cn1cnc2cccnc21.Cn1cnc2cnccc21.Cn1cnc2cncnc21.Cn1nnnc1-c1ccccc1
InChIInChI=1S/C10H10N2.2C10H9N.C9H9N3.3C9H8N2S.C9H9N.C8H8N4.C8H7N3S.2C8H8N2.2C8H7NS.C7H7N3.C7H9N3.C7H7N3.C7H9N3.2C7H7N3.C6H6N4.19CH4/c1-12-7-10(11-8-12)9-5-3-2-4-6-9;1-8-6-9-4-2-3-5-10(9)11-7-8;1-8-6-7-11-10-5-3-2-4-9(8)10;1-12-7-10-9(11-12)8-5-3-2-4-6-8;1-7-6-12-9(11-7)8-2-4-10-5-3-8;1-7-11-9(6-12-7)8-3-2-4-10-5-8;1-7-6-12-9(11-7)8-4-2-3-5-10-8;1-7-3-2-4-9-8(7)5-6-10-9;1-12-8(9-10-11-12)7-5-3-2-4-6-7;1-6-10-11-8(12-6)7-3-2-4-9-5-7;2*1-10-6-9-7-4-2-3-5-8(7)10;1-6-2-4-9-8-7(6)3-5-10-8;1-6-9-7-4-2-3-5-8(7)10-6;1-10-5-9-6-4-8-3-2-7(6)10;1-10-3-2-6-7(4-10)9-5-8-6;1-5-9-6-2-3-8-4-7(6)10-5;1-10-5-9-7-6(10)3-2-4-8-7;1-10-5-9-6-3-2-4-8-7(6)10;1-5-9-6-3-2-4-8-7(6)10-5;1-10-4-9-5-2-7-3-8-6(5)10;;;;;;;;;;;;;;;;;;;/h2-8H,1H3;2*2-7H,1H3;2-7H,1H3;3*2-6H,1H3;2-6,10H,1H3;2-6H,1H3;2-5H,1H3;2*2-6H,1H3;3*2-5H,1H3;2-4,9H,5H2,1H3;2-4H,1H3,(H,9,10);2-4H,5H2,1H3,(H,8,9);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;19*1H4
InChIKeyIJZDXVHMGKQERJ-UHFFFAOYSA-N
MW3405.78 g/mol
LogP47.92
Rot. Bonds7

About methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine

methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine (PubChem CID 158721554) has the molecular formula C190H243N49S6 and a molecular weight of 3405.78 g/mol. Its IUPAC name is methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine.

Molecular Properties

Compound Namemethane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine
PubChem CID158721554
Molecular FormulaC190H243N49S6
Molecular Weight3405.78 g/mol
Exact Mass3402.88
IUPAC Namemethane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CN1C=CC2=NCNC2=C1.CN1CNc2ncccc21.Cc1cccc2[nH]ccc12.Cc1ccnc2ccccc12.Cc1ccnc2sccc12.Cc1cnc2ccccc2c1.Cc1csc(-c2ccccn2)n1.Cc1csc(-c2ccncc2)n1.Cc1nc(-c2cccnc2)cs1.Cc1nc2ccccc2s1.Cc1nc2ccncc2[nH]1.Cc1nc2ncccc2[nH]1.Cc1nnc(-c2cccnc2)s1.Cn1cnc(-c2ccccc2)c1.Cn1cnc(-c2ccccc2)n1.Cn1cnc2ccccc21.Cn1cnc2ccccc21.Cn1cnc2cccnc21.Cn1cnc2cnccc21.Cn1cnc2cncnc21.Cn1nnnc1-c1ccccc1
InChIInChI=1S/C10H10N2.2C10H9N.C9H9N3.3C9H8N2S.C9H9N.C8H8N4.C8H7N3S.2C8H8N2.2C8H7NS.C7H7N3.C7H9N3.C7H7N3.C7H9N3.2C7H7N3.C6H6N4.19CH4/c1-12-7-10(11-8-12)9-5-3-2-4-6-9;1-8-6-9-4-2-3-5-10(9)11-7-8;1-8-6-7-11-10-5-3-2-4-9(8)10;1-12-7-10-9(11-12)8-5-3-2-4-6-8;1-7-6-12-9(11-7)8-2-4-10-5-3-8;1-7-11-9(6-12-7)8-3-2-4-10-5-8;1-7-6-12-9(11-7)8-4-2-3-5-10-8;1-7-3-2-4-9-8(7)5-6-10-9;1-12-8(9-10-11-12)7-5-3-2-4-6-7;1-6-10-11-8(12-6)7-3-2-4-9-5-7;2*1-10-6-9-7-4-2-3-5-8(7)10;1-6-2-4-9-8-7(6)3-5-10-8;1-6-9-7-4-2-3-5-8(7)10-6;1-10-5-9-6-4-8-3-2-7(6)10;1-10-3-2-6-7(4-10)9-5-8-6;1-5-9-6-2-3-8-4-7(6)10-5;1-10-5-9-7-6(10)3-2-4-8-7;1-10-5-9-6-3-2-4-8-7(6)10;1-5-9-6-3-2-4-8-7(6)10-5;1-10-4-9-5-2-7-3-8-6(5)10;;;;;;;;;;;;;;;;;;;/h2-8H,1H3;2*2-7H,1H3;2-7H,1H3;3*2-6H,1H3;2-6,10H,1H3;2-6H,1H3;2-5H,1H3;2*2-6H,1H3;3*2-5H,1H3;2-4,9H,5H2,1H3;2-4H,1H3,(H,9,10);2-4H,5H2,1H3,(H,8,9);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;19*1H4
InChIKeyIJZDXVHMGKQERJ-UHFFFAOYSA-N
XLogP47.92
TPSA555.08 Ų
H-Bond Donors5
H-Bond Acceptors52
Rotatable Bonds7
Heavy Atoms245
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003405.78
LogP ≤ 547.92
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1052

Analyze methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine with MolForge

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Related Compounds

3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-5-[5-[[3-[7-(5-fluorothiophen-2-yl)-2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]piperidin-1-yl]methyl]-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridine
CID 137024832
5-[7-[2-[2-[5-[5-(dimethylamino)-3-pyridinyl]-1H-pyrazolo[5,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]-5-fluorothiophen-3-yl]-3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-1H-pyrazolo[5,4-b]pyridin-7-ium-5-yl]pyridin-3-amine
CID 137108100
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridine;3-[4-(5-methylthiophen-2-yl)-1H-benzimidazol-2-yl]-5-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridine
CID 145664888
3-(1H-benzimidazol-2-yl)-5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridine;N-[[5-[3-(1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]-1-cyclopentylmethanamine;3-(1H-benzimidazol-2-yl)-5-pyrimidin-5-yl-2H-pyrazolo[3,4-b]pyridine;3-methyl-N-[5-[3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;N-[5-[3-(4-thiophen-3-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide
CID 157087490
2,3-Diphenylindazole;1-fluoro-2-phenylimidazo[1,2-a]quinoline;2-[2-fluoro-4-(trifluoromethyl)phenyl]pyridine;2-naphthalen-2-ylimidazo[1,2-a]pyridine;2-phenyl-1,3-benzothiazole;2-phenylimidazo[1,2-a]pyridine;1-phenylindazole;2-phenylindazole;1-phenylisoquinoline;3-phenylisoquinoline;2-phenylpyrazolo[1,5-a]pyridine;2-phenylpyridine;2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine;2-thiophen-2-ylpyridine
CID 157653295
1H-benzimidazole;1,3-dihydroimidazol-2-one;11,11-dimethylbenzo[c][1]benzazepine;1H-imidazole;isoquinoline;phenanthridine;4-phenylpyridine;1-phenylquinazolin-2-one;pyrazine;1H-pyrazole;pyridine;pyrimidine;quinoline;1,3-thiazole;1,2,4-triazine;1H-1,2,4-triazole;3-(trifluoromethyl)pyridine
CID 157705336
4-fluoro-6-(2-methylimidazo[1,2-b]pyridazin-6-yl)-2-piperidin-4-yl-1,3-benzothiazole;6-(2-methyl-3H-benzimidazol-5-yl)-2-piperidin-4-yl-1,3-benzothiazole;N-methyl-6-[2-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3-benzothiazol-2-amine
CID 158248038
2,3-Diphenylindazole;1-fluoro-2-phenylimidazo[1,2-a]quinoline;2-[2-fluoro-4-(trifluoromethyl)phenyl]pyridine;2-phenyl-1,3-benzothiazole;2-phenylimidazo[1,2-a]pyridine;1-phenylindazole;2-phenylindazole;1-phenylisoquinoline;3-phenylisoquinoline;2-phenylpyrazolo[1,5-a]pyridine;2-phenylpyridine;2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine;2-thiophen-2-ylpyridine
CID 158435881
1H-benzimidazole;1,3-dihydroimidazol-2-one;11,11-dimethylbenzo[c][1]benzazepine;1H-imidazole;isoquinoline;phenanthridine;4-phenylpyridine;1-phenylquinazolin-2-one;pyrazine;1H-pyrazole;pyridine;pyrimidine;quinoline;1,3-thiazole;1,3,5-triazine;1H-1,2,4-triazole;3-(trifluoromethyl)pyridine
CID 159230519
5-tert-butyl-1-methyl-3-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]indazole;3-(4,4-dimethylpiperazin-4-ium-1-yl)-1-methyl-5-propan-2-ylindazole;1,3-dimethyl-5-propan-2-ylpyrazolo[4,3-d]pyrimidine;1,3-dimethyl-5-(4-propan-2-yl-2-pyridinyl)pyrazolo[4,3-d]pyrimidine;1-methyl-5-[(2S)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-[(2R)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-(2-methyl-5-propan-2-yl-3-pyridinyl)pyrazolo[4,5-b]pyridine;2-propan-2-yl-5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazole;6-(4-propan-2-ylpyrimidin-2-yl)quinolin-2-amine
CID 159439054
2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylimidazo[4,5-h]quinoline;4-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-5-methyl-7-thia-3,5,12-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3H-pyrrolo[3,2-h]quinoline;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-[1,2,4]triazolo[5,1-a]isoquinoline;3-methyl-2-[2-[7-methyl-4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]ethyl]benzo[e]benzimidazole
CID 159820862
1-cyclopentyl-N-[[5-[3-(4-thiophen-2-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]methanamine;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-3-(4-thiophen-2-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridine;N-[5-[3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-3-methylbutanamide;N-[5-[3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide;5-pyrimidin-5-yl-3-(4-thiophen-2-yl-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridine
CID 160019057

Frequently Asked Questions

What is the IUPAC name of methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine?
The IUPAC name of methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine (CID 158721554) is methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine.
What is the SMILES notation for methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine?
The canonical SMILES for methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CN1C=CC2=NCNC2=C1.CN1CNc2ncccc21.Cc1cccc2[nH]ccc12.Cc1ccnc2ccccc12.Cc1ccnc2sccc12.Cc1cnc2ccccc2c1.Cc1csc(-c2ccccn2)n1.Cc1csc(-c2ccncc2)n1.Cc1nc(-c2cccnc2)cs1.Cc1nc2ccccc2s1.Cc1nc2ccncc2[nH]1.Cc1nc2ncccc2[nH]1.Cc1nnc(-c2cccnc2)s1.Cn1cnc(-c2ccccc2)c1.Cn1cnc(-c2ccccc2)n1.Cn1cnc2ccccc21.Cn1cnc2ccccc21.Cn1cnc2cccnc21.Cn1cnc2cnccc21.Cn1cnc2cncnc21.Cn1nnnc1-c1ccccc1.
What is the InChIKey of methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine?
The InChIKey is IJZDXVHMGKQERJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2.2C10H9N.C9H9N3.3C9H8N2S.C9H9N.C8H8N4.C8H7N3S.2C8H8N2.2C8H7NS.C7H7N3.C7H9N3.C7H7N3.C7H9N3.2C7H7N3.C6H6N4.19CH4/c1-12-7-10(11-8-12)9-5-3-2-4-6-9;1-8-6-9-4-2-3-5-10(9)11-7-8;1-8-6-7-11-10-5-3-2-4-9(8)10;1-12-7-10-9(11-12)8-5-3-2-4-6-8;1-7-6-12-9(11-7)8-2-4-10-5-3-8;1-7-11-9(6-12-7)8-3-2-4-10-5-8;1-7-6-12-9(11-7)8-4-2-3-5-10-8;1-7-3-2-4-9-8(7)5-6-10-9;1-12-8(9-10-11-12)7-5-3-2-4-6-7;1-6-10-11-8(12-6)7-3-2-4-9-5-7;2*1-10-6-9-7-4-2-3-5-8(7)10;1-6-2-4-9-8-7(6)3-5-10-8;1-6-9-7-4-2-3-5-8(7)10-6;1-10-5-9-6-4-8-3-2-7(6)10;1-10-3-2-6-7(4-10)9-5-8-6;1-5-9-6-2-3-8-4-7(6)10-5;1-10-5-9-7-6(10)3-2-4-8-7;1-10-5-9-6-3-2-4-8-7(6)10;1-5-9-6-3-2-4-8-7(6)10-5;1-10-4-9-5-2-7-3-8-6(5)10;;;;;;;;;;;;;;;;;;;/h2-8H,1H3;2*2-7H,1H3;2-7H,1H3;3*2-6H,1H3;2-6,10H,1H3;2-6H,1H3;2-5H,1H3;2*2-6H,1H3;3*2-5H,1H3;2-4,9H,5H2,1H3;2-4H,1H3,(H,9,10);2-4H,5H2,1H3,(H,8,9);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;19*1H4.
What are the key properties of methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine?
methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine has a molecular weight of 3405.78 g/mol, XLogP of 47.92, 7 rotatable bonds, 5 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for methane;bis(1-methylbenzimidazole);2-methyl-1,3-benzothiazole;1-methyl-2,3-dihydroimidazo[4,5-b]pyridine;5-methyl-2,3-dihydroimidazo[4,5-c]pyridine;2-methyl-1H-imidazo[4,5-b]pyridine;3-methylimidazo[4,5-b]pyridine;1-methylimidazo[4,5-c]pyridine;2-methyl-3H-imidazo[4,5-c]pyridine;4-methyl-1H-indole;1-methyl-4-phenylimidazole;1-methyl-5-phenyltetrazole;1-methyl-3-phenyl-1,2,4-triazole;9-methylpurine;2-methyl-5-pyridin-3-yl-1,3,4-thiadiazole;2-methyl-4-pyridin-3-yl-1,3-thiazole;4-methyl-2-pyridin-2-yl-1,3-thiazole;4-methyl-2-pyridin-4-yl-1,3-thiazole;3-methylquinoline;4-methylquinoline;4-methylthieno[2,3-b]pyridine is sourced from PubChem (CID 158721554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).