5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide

C213H316F4N54O7S — CID 158390649

IUPAC5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide
SMILESCC(C)(C)c1ccc(C(F)(F)F)nn1.CC(C)(C)c1ccc2nccn2n1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccnc(N2CCOCC2)n1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnc(N2CCOCC2)cn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cncnc1.CC(C)(C)c1nccn2ncnc12.CC(C)(C)c1ncnc2occc12.CC(C)(C)c1ncncc1F.CC(C)(C)c1ncsn1.CN(C)c1cc(C(C)(C)C)ncn1.CN(C)c1ccc(C(C)(C)C)nn1.CN(C)c1cnc(C(C)(C)C)cn1.COCc1cc(C(C)(C)C)ncn1.COCc1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)nn1.Cc1cc(C(=O)N(C)C)nc(C(C)(C)C)n1.Cn1ccc2cccc(C(C)(C)C)c21.Cn1ncc2ncnc(C(C)(C)C)c21
InChIInChI=1S/C13H17N.3C12H19N3O.C11H17NO.C10H14N4.2C10H13N3.3C10H17N3.C10H12N2O.C10H16N2O.C9H11F3N2.C9H12N4.C9H14N2O.C8H11FN2.4C8H12N2.C6H10N2S/c1-13(2,3)11-7-5-6-10-8-9-14(4)12(10)11;1-12(2,3)10-8-14-11(9-13-10)15-4-6-16-7-5-15;1-12(2,3)10-4-5-13-11(14-10)15-6-8-16-9-7-15;1-8-7-9(10(16)15(5)6)14-11(13-8)12(2,3)4;1-11(2,3)10-7-5-6-9(12-10)8-13-4;1-10(2,3)9-8-7(11-6-12-9)5-13-14(8)4;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-4-5-9-11-6-7-13(9)12-8;1-10(2,3)8-6-12-9(7-11-8)13(4)5;1-10(2,3)8-6-9(13(4)5)12-7-11-8;1-10(2,3)8-6-7-9(12-11-8)13(4)5;1-10(2,3)8-7-4-5-13-9(7)12-6-11-8;1-10(2,3)9-5-8(6-13-4)11-7-12-9;1-8(2,3)6-4-5-7(14-13-6)9(10,11)12;1-9(2,3)7-8-11-6-12-13(8)5-4-10-7;1-9(2,3)7-5-6-8(12-4)11-10-7;1-8(2,3)7-6(9)4-10-5-11-7;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)7-5-4-6-9-10-7;1-6(2,3)5-7-4-9-8-5/h5-9H,1-4H3;8-9H,4-7H2,1-3H3;4-5H,6-9H2,1-3H3;7H,1-6H3;5-7H,8H2,1-4H3;5-6H,1-4H3;2*4-7H,1-3H3;3*6-7H,1-5H3;4-6H,1-3H3;5,7H,6H2,1-4H3;4-5H,1-3H3;4-6H,1-3H3;5-6H,1-4H3;4-5H,1-3H3;4*4-6H,1-3H3;4H,1-3H3
InChIKeyGWXPTHMKINBZBK-UHFFFAOYSA-N
MW3853.30 g/mol
LogP43.53
Rot. Bonds11

About 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide

5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide (PubChem CID 158390649) has the molecular formula C213H316F4N54O7S and a molecular weight of 3853.30 g/mol. Its IUPAC name is 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide
PubChem CID158390649
Molecular FormulaC213H316F4N54O7S
Molecular Weight3853.30 g/mol
Exact Mass3850.57
IUPAC Name5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide
SMILESCC(C)(C)c1ccc(C(F)(F)F)nn1.CC(C)(C)c1ccc2nccn2n1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccnc(N2CCOCC2)n1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnc(N2CCOCC2)cn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cncnc1.CC(C)(C)c1nccn2ncnc12.CC(C)(C)c1ncnc2occc12.CC(C)(C)c1ncncc1F.CC(C)(C)c1ncsn1.CN(C)c1cc(C(C)(C)C)ncn1.CN(C)c1ccc(C(C)(C)C)nn1.CN(C)c1cnc(C(C)(C)C)cn1.COCc1cc(C(C)(C)C)ncn1.COCc1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)nn1.Cc1cc(C(=O)N(C)C)nc(C(C)(C)C)n1.Cn1ccc2cccc(C(C)(C)C)c21.Cn1ncc2ncnc(C(C)(C)C)c21
InChIInChI=1S/C13H17N.3C12H19N3O.C11H17NO.C10H14N4.2C10H13N3.3C10H17N3.C10H12N2O.C10H16N2O.C9H11F3N2.C9H12N4.C9H14N2O.C8H11FN2.4C8H12N2.C6H10N2S/c1-13(2,3)11-7-5-6-10-8-9-14(4)12(10)11;1-12(2,3)10-8-14-11(9-13-10)15-4-6-16-7-5-15;1-12(2,3)10-4-5-13-11(14-10)15-6-8-16-9-7-15;1-8-7-9(10(16)15(5)6)14-11(13-8)12(2,3)4;1-11(2,3)10-7-5-6-9(12-10)8-13-4;1-10(2,3)9-8-7(11-6-12-9)5-13-14(8)4;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-4-5-9-11-6-7-13(9)12-8;1-10(2,3)8-6-12-9(7-11-8)13(4)5;1-10(2,3)8-6-9(13(4)5)12-7-11-8;1-10(2,3)8-6-7-9(12-11-8)13(4)5;1-10(2,3)8-7-4-5-13-9(7)12-6-11-8;1-10(2,3)9-5-8(6-13-4)11-7-12-9;1-8(2,3)6-4-5-7(14-13-6)9(10,11)12;1-9(2,3)7-8-11-6-12-13(8)5-4-10-7;1-9(2,3)7-5-6-8(12-4)11-10-7;1-8(2,3)7-6(9)4-10-5-11-7;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)7-5-4-6-9-10-7;1-6(2,3)5-7-4-9-8-5/h5-9H,1-4H3;8-9H,4-7H2,1-3H3;4-5H,6-9H2,1-3H3;7H,1-6H3;5-7H,8H2,1-4H3;5-6H,1-4H3;2*4-7H,1-3H3;3*6-7H,1-5H3;4-6H,1-3H3;5,7H,6H2,1-4H3;4-5H,1-3H3;4-6H,1-3H3;5-6H,1-4H3;4-5H,1-3H3;4*4-6H,1-3H3;4H,1-3H3
InChIKeyGWXPTHMKINBZBK-UHFFFAOYSA-N
XLogP43.53
TPSA673.16 Ų
H-Bond Donors
H-Bond Acceptors61
Rotatable Bonds11
Heavy Atoms279
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003853.30
LogP ≤ 543.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1061

Analyze 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide with MolForge

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Related Compounds

N-[(2S)-1-[5-(1,1-difluoroethyl)pyrazin-2-yl]oxypropan-2-yl]-N-ethyl-2-methyl-4-phenylpyrimidine-5-carboxamide;N-[(2S)-1-[5-(1,1-difluoroethyl)pyrazin-2-yl]oxypropan-2-yl]-N-ethyl-6-methyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-5-fluoro-2-(triazol-2-yl)pyridine-3-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-6-methyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine-3-carboxamide;N-ethyl-6-methyl-N-[(2S)-1-[(5-methyl-2-pyridinyl)oxy]propan-2-yl]-3-(triazol-2-yl)pyridine-2-carboxamide
CID 157682785
Acetonitrile;1,2-dimethylbenzimidazole;3,6-dimethylimidazo[4,5-b]pyridine;1,4-dimethylpyridin-2-one;ethane;2-fluoro-5-methylpyridine;2-(2-fluorophenyl)-4-methyl-1,3-thiazole;1-(5-isocyano-4-methyl-3-pyridinyl)ethanone;methoxymethane;1-methylbenzimidazole;6-methylfuro[3,2-b]pyridine;1-methylindazole;methyl 5-methylpyridine-2-carboxylate;2-methyl-1-phenylbenzimidazole;pentakis(2-methylpyrazine);bis(4-methylpyridazine);2-methylpyridine;3-methylpyridine;4-methylpyridine;5-methylpyridine-2-carbonitrile;2-methylquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;5-methyl-2-(trifluoromethyl)pyridine;1,1,1-trifluoroethane
CID 158004282
[2-[(5-Fluoropyrimidin-2-yl)oxymethyl]-7-azabicyclo[2.2.1]heptan-7-yl]-[6-methyl-3-(4-methyl-1,3-oxazol-2-yl)-2-pyridinyl]methanone;[6-methyl-3-(4-methyl-1,3-oxazol-2-yl)-2-pyridinyl]-[2-(pyridin-2-yloxymethyl)-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[5-methyl-2-(triazol-2-yl)phenyl]-[2-[[6-methyl-2-(trifluoromethyl)pyrimidin-4-yl]oxymethyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[2-(triazol-2-yl)phenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 158051729
1,2-Dimethylbenzimidazole;3,6-dimethylimidazo[4,5-b]pyridine;bis(2,5-dimethylpyridine);1,4-dimethylpyridin-2-one;ethane;2-(2-fluorophenyl)-4-methyl-1,3-thiazole;1-(3-isocyano-2-methylphenyl)ethanone;1-methylbenzimidazole;6-methylfuro[3,2-b]pyridine;1-methylindole;methyl 5-methylpyridine-2-carboxylate;2-methyl-1-phenylbenzimidazole;pentakis(2-methylpyrazine);6-methylpyrazolo[1,5-a]pyridine;2-methylpyridine;tris(3-methylpyridine);2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine;toluene
CID 158253580
[3-(1,1-difluoroethyl)-4-fluorophenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2,6-difluorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(1,5-dimethylpyrrol-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-methoxypyrazin-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methoxy-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-methylpyrimidin-5-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-2-ylmethanone
CID 158342124
[3-(1,1-difluoroethyl)-4-fluorophenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2,6-difluorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-methoxypyrazin-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methoxy-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-methylpyrimidin-5-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-2-ylmethanone
CID 158487104
N-[(2S)-1-[[5-(1,1-difluoroethyl)-3-fluoro-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-5-fluoro-2-(triazol-2-yl)pyridine-3-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-3-fluoro-5-(triazol-2-yl)pyridine-4-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-5-methyl-2-(1-methylpyrazol-3-yl)pyridine-3-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-[(2S)-1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]oxypropan-2-yl]-N-ethyl-6-methyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-ethyl-5-fluoro-N-[(2S)-1-[(5-methyl-2-pyridinyl)oxy]propan-2-yl]-2-(triazol-2-yl)pyridine-3-carboxamide
CID 158641643
Acetonitrile;1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;bis(2,5-dimethylpyridine);1,4-dimethylpyridin-2-one;ethane;2-fluoro-5-methylpyridine;2-(2-fluorophenyl)-4-methyl-1,3-thiazole;1-(3-isocyano-2-methylphenyl)ethanone;methane;methoxymethane;1-methylbenzimidazole;6-methylfuro[3,2-b]pyridine;1-methylindazole;methyl 5-methylpyridine-2-carboxylate;2-methyl-1-phenylbenzimidazole;pentakis(2-methylpyrazine);bis(4-methylpyridazine);2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;1,1,1-trifluoroethane
CID 161544054
[3-(1,1-difluoroethyl)-4-fluorophenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2,6-difluorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-fluoro-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-methoxypyrazin-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methoxy-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-methylpyrimidin-5-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-2-ylmethanone
CID 161758273
1-[4-[(2R,5R)-5-[5-amino-8-methyl-7-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-[(1S)-3,3-difluorocyclopentyl]-7-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;6-(2,5-difluorophenyl)-5-methyl-2-[(3R)-1-(1-methylpyrazol-4-yl)piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyrazin-8-amine;2-[1-(3-fluoro-2-pyridinyl)cyclopropyl]-5-methyl-6-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine;5-methyl-2-[(3S)-1-(1-methylpyrazol-4-yl)piperidin-3-yl]-6-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
CID 163841195
[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone;[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methanone;methane;[(2S)-2-[(5-methyl-2-pyridinyl)oxymethyl]pyrrolidin-1-yl]-(2-phenyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-yl)methanone;[(2S)-2-[(5-methyl-2-pyridinyl)oxymethyl]pyrrolidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone;(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-[(2S)-2-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]pyrrolidin-1-yl]methanone
CID 167626177
[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone;[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methanone;methane;[(2S)-2-[(5-methyl-2-pyridinyl)oxymethyl]pyrrolidin-1-yl]-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methanone;(2-phenyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-yl)-[(2S)-2-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]pyrrolidin-1-yl]methanone;(2-phenylimidazo[1,2-a]pyridin-3-yl)-[(2S)-2-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]pyrrolidin-1-yl]methanone
CID 167655301

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide?
The IUPAC name of 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide (CID 158390649) is 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide?
The canonical SMILES for 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide is CC(C)(C)c1ccc(C(F)(F)F)nn1.CC(C)(C)c1ccc2nccn2n1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccnc(N2CCOCC2)n1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnc(N2CCOCC2)cn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cncnc1.CC(C)(C)c1nccn2ncnc12.CC(C)(C)c1ncnc2occc12.CC(C)(C)c1ncncc1F.CC(C)(C)c1ncsn1.CN(C)c1cc(C(C)(C)C)ncn1.CN(C)c1ccc(C(C)(C)C)nn1.CN(C)c1cnc(C(C)(C)C)cn1.COCc1cc(C(C)(C)C)ncn1.COCc1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)nn1.Cc1cc(C(=O)N(C)C)nc(C(C)(C)C)n1.Cn1ccc2cccc(C(C)(C)C)c21.Cn1ncc2ncnc(C(C)(C)C)c21.
What is the InChIKey of 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide?
The InChIKey is GWXPTHMKINBZBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N.3C12H19N3O.C11H17NO.C10H14N4.2C10H13N3.3C10H17N3.C10H12N2O.C10H16N2O.C9H11F3N2.C9H12N4.C9H14N2O.C8H11FN2.4C8H12N2.C6H10N2S/c1-13(2,3)11-7-5-6-10-8-9-14(4)12(10)11;1-12(2,3)10-8-14-11(9-13-10)15-4-6-16-7-5-15;1-12(2,3)10-4-5-13-11(14-10)15-6-8-16-9-7-15;1-8-7-9(10(16)15(5)6)14-11(13-8)12(2,3)4;1-11(2,3)10-7-5-6-9(12-10)8-13-4;1-10(2,3)9-8-7(11-6-12-9)5-13-14(8)4;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-4-5-9-11-6-7-13(9)12-8;1-10(2,3)8-6-12-9(7-11-8)13(4)5;1-10(2,3)8-6-9(13(4)5)12-7-11-8;1-10(2,3)8-6-7-9(12-11-8)13(4)5;1-10(2,3)8-7-4-5-13-9(7)12-6-11-8;1-10(2,3)9-5-8(6-13-4)11-7-12-9;1-8(2,3)6-4-5-7(14-13-6)9(10,11)12;1-9(2,3)7-8-11-6-12-13(8)5-4-10-7;1-9(2,3)7-5-6-8(12-4)11-10-7;1-8(2,3)7-6(9)4-10-5-11-7;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)7-5-4-6-9-10-7;1-6(2,3)5-7-4-9-8-5/h5-9H,1-4H3;8-9H,4-7H2,1-3H3;4-5H,6-9H2,1-3H3;7H,1-6H3;5-7H,8H2,1-4H3;5-6H,1-4H3;2*4-7H,1-3H3;3*6-7H,1-5H3;4-6H,1-3H3;5,7H,6H2,1-4H3;4-5H,1-3H3;4-6H,1-3H3;5-6H,1-4H3;4-5H,1-3H3;4*4-6H,1-3H3;4H,1-3H3.
What are the key properties of 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide?
5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide has a molecular weight of 3853.30 g/mol, XLogP of 43.53, 11 rotatable bonds, 0 hydrogen bond donors, and 61 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-N,N-dimethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyridazin-3-amine;6-tert-butyl-N,N-dimethylpyrimidin-4-amine;4-tert-butyl-5-fluoropyrimidine;4-tert-butylfuro[2,3-d]pyrimidine;6-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-6-(methoxymethyl)pyridine;4-tert-butyl-6-(methoxymethyl)pyrimidine;3-tert-butyl-6-methoxypyridazine;7-tert-butyl-1-methylindole;7-tert-butyl-1-methylpyrazolo[4,5-d]pyrimidine;2-tert-butylpyrazine;4-(5-tert-butylpyrazin-2-yl)morpholine;5-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyridazine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;4-(4-tert-butylpyrimidin-2-yl)morpholine;3-tert-butyl-1,2,4-thiadiazole;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyrazine;3-tert-butyl-6-(trifluoromethyl)pyridazine;2-tert-butyl-N,N,6-trimethylpyrimidine-4-carboxamide is sourced from PubChem (CID 158390649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).