bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine

C147H174F4N34O3S — CID 159911264

IUPACbis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine
SMILESC.C.C.C.C.Cc1c(F)ccc2ncncc12.Cc1cc2c(C)cccc2[nH]1.Cc1cc2c(C)cccc2[nH]1.Cc1ccc2nc(N3CCOCC3)nc(C)c2c1.Cc1ccc2ncnc(C)c2c1.Cc1cccc2[nH]ccc12.Cc1ccnnc1C.Cc1csc(N2CCOCC2)n1.Cc1nc(C)c2cc(F)ccc2n1.Cc1nc(N2CCOCC2)ncc1F.Cc1ncc2c(C)c(F)ccc2n1.Cc1nccc2cccn12.Cc1nccc2nccn12.Cc1ncnc2[nH]ccc12.Cc1ncnc2c1CCCC2.Cc1ncncc1C#N
InChIInChI=1S/C14H17N3O.2C10H9FN2.C10H10N2.2C10H11N.C9H12FN3O.C9H7FN2.C9H12N2.C9H9N.C8H12N2OS.C8H8N2.2C7H7N3.C6H5N3.C6H8N2.5CH4/c1-10-3-4-13-12(9-10)11(2)15-14(16-13)17-5-7-18-8-6-17;1-6-8-5-12-7(2)13-10(8)4-3-9(6)11;1-6-9-5-8(11)3-4-10(9)13-7(2)12-6;1-7-3-4-10-9(5-7)8(2)11-6-12-10;2*1-7-4-3-5-10-9(7)6-8(2)11-10;1-7-8(10)6-11-9(12-7)13-2-4-14-5-3-13;1-6-7-4-11-5-12-9(7)3-2-8(6)10;1-7-8-4-2-3-5-9(8)11-6-10-7;1-7-3-2-4-9-8(7)5-6-10-9;1-7-6-12-8(9-7)10-2-4-11-5-3-10;1-7-9-5-4-8-3-2-6-10(7)8;1-6-8-3-2-7-9-4-5-10(6)7;1-5-6-2-3-8-7(6)10-4-9-5;1-5-6(2-7)3-8-4-9-5;1-5-3-4-7-8-6(5)2;;;;;/h3-4,9H,5-8H2,1-2H3;2*3-5H,1-2H3;3-6H,1-2H3;2*3-6,11H,1-2H3;6H,2-5H2,1H3;2-5H,1H3;6H,2-5H2,1H3;2-6,10H,1H3;6H,2-5H2,1H3;2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,8,9,10);3-4H,1H3;3-4H,1-2H3;5*1H4
InChIKeyNXFCBEJMMAHLFF-UHFFFAOYSA-N
MW2573.30 g/mol
LogP31.81
Rot. Bonds3

About bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine

bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine (PubChem CID 159911264) has the molecular formula C147H174F4N34O3S and a molecular weight of 2573.30 g/mol. Its IUPAC name is bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine.

Molecular Properties

Compound Namebis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine
PubChem CID159911264
Molecular FormulaC147H174F4N34O3S
Molecular Weight2573.30 g/mol
Exact Mass2571.42
IUPAC Namebis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine
SMILESC.C.C.C.C.Cc1c(F)ccc2ncncc12.Cc1cc2c(C)cccc2[nH]1.Cc1cc2c(C)cccc2[nH]1.Cc1ccc2nc(N3CCOCC3)nc(C)c2c1.Cc1ccc2ncnc(C)c2c1.Cc1cccc2[nH]ccc12.Cc1ccnnc1C.Cc1csc(N2CCOCC2)n1.Cc1nc(C)c2cc(F)ccc2n1.Cc1nc(N2CCOCC2)ncc1F.Cc1ncc2c(C)c(F)ccc2n1.Cc1nccc2cccn12.Cc1nccc2nccn12.Cc1ncnc2[nH]ccc12.Cc1ncnc2c1CCCC2.Cc1ncncc1C#N
InChIInChI=1S/C14H17N3O.2C10H9FN2.C10H10N2.2C10H11N.C9H12FN3O.C9H7FN2.C9H12N2.C9H9N.C8H12N2OS.C8H8N2.2C7H7N3.C6H5N3.C6H8N2.5CH4/c1-10-3-4-13-12(9-10)11(2)15-14(16-13)17-5-7-18-8-6-17;1-6-8-5-12-7(2)13-10(8)4-3-9(6)11;1-6-9-5-8(11)3-4-10(9)13-7(2)12-6;1-7-3-4-10-9(5-7)8(2)11-6-12-10;2*1-7-4-3-5-10-9(7)6-8(2)11-10;1-7-8(10)6-11-9(12-7)13-2-4-14-5-3-13;1-6-7-4-11-5-12-9(7)3-2-8(6)10;1-7-8-4-2-3-5-9(8)11-6-10-7;1-7-3-2-4-9-8(7)5-6-10-9;1-7-6-12-8(9-7)10-2-4-11-5-3-10;1-7-9-5-4-8-3-2-6-10(7)8;1-6-8-3-2-7-9-4-5-10(6)7;1-5-6-2-3-8-7(6)10-4-9-5;1-5-6(2-7)3-8-4-9-5;1-5-3-4-7-8-6(5)2;;;;;/h3-4,9H,5-8H2,1-2H3;2*3-5H,1-2H3;3-6H,1-2H3;2*3-6,11H,1-2H3;6H,2-5H2,1H3;2-5H,1H3;6H,2-5H2,1H3;2-6,10H,1H3;6H,2-5H2,1H3;2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,8,9,10);3-4H,1H3;3-4H,1-2H3;5*1H4
InChIKeyNXFCBEJMMAHLFF-UHFFFAOYSA-N
XLogP31.81
TPSA442.54 Ų
H-Bond Donors4
H-Bond Acceptors34
Rotatable Bonds3
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002573.30
LogP ≤ 531.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1034

Analyze bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine with MolForge

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Launch Full Analysis

Related Compounds

CID 157582218
CID 157582218
5-chloro-4-methylpyrimidin-2-amine;4-chloro-2-methyl-3-(trifluoromethyl)pyridine;2-(4,4-difluoropiperidin-1-yl)-4,5-dimethylpyrimidine;2,4-dimethyl-1H-indole;3,4-dimethylpyridazine;4,5-dimethylpyrimidin-2-amine;bis(4,5-dimethylpyrimidine);4,5-dimethylpyrimidine-2-carboxamide;4-(4,5-dimethylpyrimidin-2-yl)morpholine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;5-fluoro-4-methyl-7H-pyrrolo[2,3-d]pyrimidine;6-fluoro-5-methylquinoline;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-(1-methylisoquinolin-3-yl)morpholine;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methylquinazoline;4-(4-methylquinazolin-2-yl)morpholine;bis(4-methyl-5,6,7,8-tetrahydroquinazoline);4-methyl-1,3-thiazole;4-(4-methyl-1,3-thiazol-2-yl)morpholine;4-methyl-2-(trifluoromethyl)-1H-indole
CID 157957855
4-chloro-2,3-dimethylpyridine;6-(3,3-difluoroazetidin-1-yl)-2,3-dimethylpyridine;2-(4,4-difluoropiperidin-1-yl)-4,5-dimethylpyrimidine;3,4-dimethylpyridazine;bis(4,5-dimethylpyrimidin-2-amine);tetrakis(4,5-dimethylpyrimidine);4,5-dimethylpyrimidine-2-carboxamide;4-(4,5-dimethylpyrimidin-2-yl)morpholine;4,6-dimethylquinazoline;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;6-fluoro-5-methylquinoline;methane;4-methyl-1H-indole;4-methylpyrimidine;bis(4-methyl-5,6,7,8-tetrahydroquinazoline);4-methyl-1,3-thiazole;4-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 159215712
4-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]ethyl]-N,N-dimethylpiperazine-1-carboxamide;1-[2-(4-ethylpiperazin-1-yl)ethyl]-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-[2-(3-methylpiperazin-1-yl)ethyl]-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-[(1-methylpyrazol-4-yl)methyl]-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-3-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-7H-cyclopenta[c]pyridine-6-carbonitrile
CID 159944940
4-methyl-1-[(4-methyl-1H-pyrazol-5-yl)methyl]-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-[(5-methyl-3H-pyrazol-4-yl)methyl]-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-(2-piperidin-1-ylethyl)-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile;4-methyl-1-(2-pyridin-3-ylethyl)-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indole-2-carbonitrile
CID 160530428
4-chloro-2,3-dimethylpyridine;2-(4,4-difluoropiperidin-1-yl)-4,5-dimethylpyrimidine;3,4-dimethylpyridazine;bis(4,5-dimethylpyrimidin-2-amine);bis(4,5-dimethylpyrimidine);4,5-dimethylpyrimidine-2-carboxamide;4-(4,5-dimethylpyrimidin-2-yl)morpholine;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,5-dimethylquinazoline;6-fluoro-2,4-dimethylquinoline;5-fluoro-4-methylpyrimidine;6-fluoro-4-methylquinazoline;6-fluoro-5-methylquinoline;4-methyl-1H-indole;4-methylpyrimidine;1-methylpyrrolo[1,2-c]pyrimidine;bis(4-methyl-5,6,7,8-tetrahydroquinazoline);4-methyl-1,3-thiazole;4-(4-methyl-1,3-thiazol-2-yl)morpholine;4-methyl-5-(trifluoromethyl)pyrimidine
CID 161052501
4-chloro-2,3-dimethylpyridine;2-(4,4-difluoropiperidin-1-yl)-4,5-dimethylpyrimidine;3,4-dimethylpyridazine;bis(4,5-dimethylpyrimidin-2-amine);bis(4,5-dimethylpyrimidine);4,5-dimethylpyrimidine-2-carboxamide;4-(4,5-dimethylpyrimidin-2-yl)morpholine;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;5-fluoro-4-methylpyrimidine;6-fluoro-4-methylquinazoline;6-fluoro-5-methylquinoline;4-methyl-1H-indole;4-methylpyrimidine;1-methylpyrrolo[1,2-c]pyrimidine;bis(4-methyl-5,6,7,8-tetrahydroquinazoline);4-methyl-1,3-thiazole;4-(4-methyl-1,3-thiazol-2-yl)morpholine;4-methyl-5-(trifluoromethyl)pyrimidine
CID 161291013
3-[2-(4-acetylpiperazin-1-yl)-4-(trifluoromethyl)pyrimidin-5-yl]-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-isoquinolin-4-yl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-isoquinolin-5-yl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-(3-oxopiperazin-1-yl)-4-(trifluoromethyl)pyrimidin-5-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(2-phenyl-1,3-thiazol-4-yl)-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-diazaspiro[4.5]decan-2-one;bis(8-[methyl(oxolan-3-ylmethyl)amino]-3-(2-morpholin-4-ylpyrimidin-5-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one)
CID 161631569
4-chloro-2,3-dimethylpyridine;2-(4,4-difluoropiperidin-1-yl)-4,5-dimethylpyrimidine;3,4-dimethylpyridazine;4,5-dimethylpyrimidin-2-amine;4,5-dimethylpyrimidine;4-(4,5-dimethylpyrimidin-2-yl)morpholine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;6-fluoro-5-methylquinoline;4-methyl-1H-indole;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-methyl-1,3-thiazole;4-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 163852616
3-tert-butyl-1-benzothiophene;8-tert-butyl-3-(3,3-difluoropyrrolidin-1-yl)isoquinoline;6-tert-butyl-1H-indole;4-(8-tert-butylisoquinolin-3-yl)morpholine;1-(8-tert-butylisoquinolin-3-yl)pyrrolidine-3-carbonitrile;4-tert-butyl-2-methylindazole;8-tert-butyl-3-(4-methylpiperazin-1-yl)isoquinoline;1-tert-butylnaphthalene;8-tert-butyl-3-piperidin-1-ylisoquinoline;8-tert-butyl-3-pyrrolidin-1-ylisoquinoline;4-tert-butylquinoline
CID 165051058
1-[4-(3,5-dimethyl-1-piperidin-4-ylpyrazol-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]benzimidazol-2-amine;N-[1-[4-(3,5-dimethyl-1-piperidin-4-ylpyrazol-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]benzimidazol-2-yl]acetamide;1-[4-(3,5-dimethyl-1-piperidin-4-ylpyrazol-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]-5-fluoro-N-methylbenzimidazol-2-amine;1-[4-(3,5-dimethyl-1-piperidin-4-ylpyrazol-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]-N-methylbenzimidazol-2-amine;4-[4-[(3R)-3-methylmorpholin-4-yl]-6-[5-methyl-1-piperidin-4-yl-3-(trifluoromethyl)pyrazol-4-yl]pyrimidin-2-yl]-1H-indole-7-carbonitrile
CID 167580458
2-[2-(1H-indol-2-yl)-1-(1,8-naphthyridin-2-yl)-7-piperazin-1-yl-4-(7H-purin-2-yl)-6-(1H-pyrazol-3-yl)benzimidazol-5-yl]-1,3-thiazole
CID 141287360

Frequently Asked Questions

What is the IUPAC name of bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The IUPAC name of bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine (CID 159911264) is bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine.
What is the SMILES notation for bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The canonical SMILES for bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine is C.C.C.C.C.Cc1c(F)ccc2ncncc12.Cc1cc2c(C)cccc2[nH]1.Cc1cc2c(C)cccc2[nH]1.Cc1ccc2nc(N3CCOCC3)nc(C)c2c1.Cc1ccc2ncnc(C)c2c1.Cc1cccc2[nH]ccc12.Cc1ccnnc1C.Cc1csc(N2CCOCC2)n1.Cc1nc(C)c2cc(F)ccc2n1.Cc1nc(N2CCOCC2)ncc1F.Cc1ncc2c(C)c(F)ccc2n1.Cc1nccc2cccn12.Cc1nccc2nccn12.Cc1ncnc2[nH]ccc12.Cc1ncnc2c1CCCC2.Cc1ncncc1C#N.
What is the InChIKey of bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The InChIKey is NXFCBEJMMAHLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O.2C10H9FN2.C10H10N2.2C10H11N.C9H12FN3O.C9H7FN2.C9H12N2.C9H9N.C8H12N2OS.C8H8N2.2C7H7N3.C6H5N3.C6H8N2.5CH4/c1-10-3-4-13-12(9-10)11(2)15-14(16-13)17-5-7-18-8-6-17;1-6-8-5-12-7(2)13-10(8)4-3-9(6)11;1-6-9-5-8(11)3-4-10(9)13-7(2)12-6;1-7-3-4-10-9(5-7)8(2)11-6-12-10;2*1-7-4-3-5-10-9(7)6-8(2)11-10;1-7-8(10)6-11-9(12-7)13-2-4-14-5-3-13;1-6-7-4-11-5-12-9(7)3-2-8(6)10;1-7-8-4-2-3-5-9(8)11-6-10-7;1-7-3-2-4-9-8(7)5-6-10-9;1-7-6-12-8(9-7)10-2-4-11-5-3-10;1-7-9-5-4-8-3-2-6-10(7)8;1-6-8-3-2-7-9-4-5-10(6)7;1-5-6-2-3-8-7(6)10-4-9-5;1-5-6(2-7)3-8-4-9-5;1-5-3-4-7-8-6(5)2;;;;;/h3-4,9H,5-8H2,1-2H3;2*3-5H,1-2H3;3-6H,1-2H3;2*3-6,11H,1-2H3;6H,2-5H2,1H3;2-5H,1H3;6H,2-5H2,1H3;2-6,10H,1H3;6H,2-5H2,1H3;2-6H,1H3;2-5H,1H3;2-4H,1H3,(H,8,9,10);3-4H,1H3;3-4H,1-2H3;5*1H4.
What are the key properties of bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine?
bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine has a molecular weight of 2573.30 g/mol, XLogP of 31.81, 3 rotatable bonds, 4 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,4-dimethyl-1H-indole);3,4-dimethylpyridazine;4,6-dimethylquinazoline;4-(4,6-dimethylquinazolin-2-yl)morpholine;6-fluoro-2,4-dimethylquinazoline;6-fluoro-2,5-dimethylquinazoline;4-(5-fluoro-4-methylpyrimidin-2-yl)morpholine;6-fluoro-5-methylquinazoline;methane;5-methylimidazo[1,2-c]pyrimidine;4-methyl-1H-indole;4-methylpyrimidine-5-carbonitrile;1-methylpyrrolo[1,2-c]pyrimidine;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;4-methyl-5,6,7,8-tetrahydroquinazoline;4-(4-methyl-1,3-thiazol-2-yl)morpholine is sourced from PubChem (CID 159911264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).