N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine

C174H175N31O30S12 — CID 167545076

IUPACN-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine
SMILESCOc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2ncco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC34CC5CC(CC(C5)C3)C4)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1.C[C@H](Nc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1ccoc1.Cn1cc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)cn1
InChIInChI=1S/C21H25N3O2S.C19H19N3O3S.C18H18N4O3S.C18H18N2O3S.C18H17NO3S2.C16H17N5O2S.2C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-27(25,26)18-4-2-17(3-5-18)19-12-22-13-20(23-19)24-21-9-14-6-15(10-21)8-16(7-14)11-21;1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(15-10-11-23-12-15)19-18-5-3-4-17(20-18)14-6-8-16(9-7-14)24(2,21)22;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-21-11-12(8-19-21)7-18-16-10-17-9-15(20-16)13-3-5-14(6-4-13)24(2,22)23;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23-16-15(11-3-5-12(6-4-11)25(2,21)22)20-13(9-19-16)18-10-14-17-7-8-24-14;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h2-5,12-16H,6-11H2,1H3,(H,23,24);3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3,(H,19,20);3-13H,1-2H3;3-6,8-11H,7H2,1-2H3,(H,18,20);3-7,9-10H,8H2,1-2H3,(H,18,20);3-9H,10H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;;2*13-;;;;;/m...01...../s1
InChIKeyBRLNEZXPTICYRI-IQFSKZNRSA-N
MW3565.30 g/mol
LogP30.32
Rot. Bonds53

About N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine

N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine (PubChem CID 167545076) has the molecular formula C174H175N31O30S12 and a molecular weight of 3565.30 g/mol. Its IUPAC name is N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine.

Molecular Properties

Compound NameN-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine
PubChem CID167545076
Molecular FormulaC174H175N31O30S12
Molecular Weight3565.30 g/mol
Exact Mass3561.98
IUPAC NameN-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine
SMILESCOc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2ncco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC34CC5CC(CC(C5)C3)C4)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1.C[C@H](Nc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1ccoc1.Cn1cc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)cn1
InChIInChI=1S/C21H25N3O2S.C19H19N3O3S.C18H18N4O3S.C18H18N2O3S.C18H17NO3S2.C16H17N5O2S.2C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-27(25,26)18-4-2-17(3-5-18)19-12-22-13-20(23-19)24-21-9-14-6-15(10-21)8-16(7-14)11-21;1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(15-10-11-23-12-15)19-18-5-3-4-17(20-18)14-6-8-16(9-7-14)24(2,21)22;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-21-11-12(8-19-21)7-18-16-10-17-9-15(20-16)13-3-5-14(6-4-13)24(2,22)23;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23-16-15(11-3-5-12(6-4-11)25(2,21)22)20-13(9-19-16)18-10-14-17-7-8-24-14;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h2-5,12-16H,6-11H2,1H3,(H,23,24);3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3,(H,19,20);3-13H,1-2H3;3-6,8-11H,7H2,1-2H3,(H,18,20);3-7,9-10H,8H2,1-2H3,(H,18,20);3-9H,10H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;;2*13-;;;;;/m...01...../s1
InChIKeyBRLNEZXPTICYRI-IQFSKZNRSA-N
XLogP30.32
TPSA838.00 Ų
H-Bond Donors8
H-Bond Acceptors63
Rotatable Bonds53
Heavy Atoms247
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003565.30
LogP ≤ 530.32
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1063

Analyze N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine with MolForge

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Related Compounds

2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 159749631
8-[[3-(Benzenesulfinyl)furan-2-yl]methyl]-6-(3-methylbut-1-en-2-yl)-2-[4-(1-methylpiperidin-3-yl)oxyanilino]pyrido[2,3-d]pyrimidin-7-one;6-(diethylamino)-2-[3-fluoro-4-(3-methylpiperazin-1-yl)anilino]-8-[[2-(1,3-thiazol-2-ylsulfonyl)pyrazol-3-yl]methyl]pyrido[2,3-d]pyrimidin-7-one;6-[1-(dimethylamino)ethenyl]-2-[4-(4-methylthiomorpholin-2-yl)anilino]-8-[[3-(2,2,2-trifluoroethylsulfonyl)imidazol-4-yl]methyl]pyrido[2,3-d]pyrimidin-7-one;2-[4-(1-methylpiperidin-4-yl)oxyanilino]-6-pentan-3-yl-8-[(2-pyridin-4-ylsulfonylfuran-3-yl)methyl]pyrido[2,3-d]pyrimidin-7-one
CID 160647292
6-(N-methylanilino)-2-[4-(1-methylpiperidin-4-yl)anilino]-8-[[2-(1,3-thiazol-2-ylsulfonyl)furan-3-yl]methyl]pyrido[2,3-d]pyrimidin-7-one;2-(3-methyl-4-piperazin-1-ylanilino)-6-[1-(oxan-4-yl)ethenyl]-8-[(2-propan-2-ylsulfonylpyrazol-3-yl)methyl]pyrido[2,3-d]pyrimidin-7-one;2-[4-(1-methylpiperidin-3-yl)anilino]-6-(1-phenylethenyl)-8-[[3-(2,2,2-trifluoroethylsulfinyl)furan-2-yl]methyl]pyrido[2,3-d]pyrimidin-7-one;6-(1-methylpiperidin-2-yl)-2-(4-morpholin-2-ylanilino)-8-[(1-pyridin-4-ylsulfonylpyrrol-2-yl)methyl]pyrido[2,3-d]pyrimidin-7-one
CID 160862244
1-tert-butyl-4-propan-2-ylcyclohexane;2-tert-butyl-5-propan-2-ylthiophene;1,1-difluoro-4-propan-2-ylcyclohexane;1,1-dimethyl-4-propan-2-ylcyclohexane;3,4-dimethyl-1-propan-2-ylpyrrolidine;1,4-di(propan-2-yl)cyclohexane;1-ethyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;2-phenyl-5-propan-2-ylthiophene;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylfuran;4-propan-2-yloxane;2-propan-2-yl-1,3-oxazole;2-propan-2-yloxolane;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-yl-2H-pyrrole;2-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;2,2,3-trimethylbutan-1-ol
CID 161694450
N-(furan-2-ylmethyl)-5-methoxy-6-(4-methylsulfonylphenyl)pyridin-2-amine;3-methyl-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,2-oxazol-3-ylmethyl)pyridin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]oxymethyl]-1,3-thiazole;3-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,2-oxazole;6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)pyrazin-2-amine
CID 167601427
5-(furan-2-ylmethoxy)-2-methoxy-3-(4-methylsulfonylphenyl)pyrazine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;N-[(4-methylfuran-2-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(1-methylpyrrol-2-yl)methyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;6-(4-methylsulfonylphenyl)-5-propan-2-yloxy-N-(thiophen-2-ylmethyl)pyrazin-2-amine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethoxy)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-5-(trifluoromethyl)pyrazin-2-amine
CID 167647384
cumene;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-methylbut-1-ene;2-methyl-4-propan-2-yl-1,3-thiazole;2-(methylsulfonylmethyl)-4-propan-2-yl-1,3-thiazole;N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(oxolan-2-ylmethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;2-propan-2-ylfuran;3-propan-2-ylfuran;4-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazol-2-amine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;(4-propan-2-yl-1,3-thiazol-2-yl)methanol;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 157213549
tert-butylbenzene;2-tert-butylfuran;3-tert-butylfuran;2-tert-butyl-1,3-oxazole;5-tert-butyl-1,3-oxazole;2-tert-butylpyrazine;3-tert-butylpyridazine;4-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;2-tert-butyl-3H-pyrrole;4-tert-butyl-3H-pyrrole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene;methane
CID 157288239
1,2-dimethylimidazole;1,2-dimethylpyrrole;methane;tris(2-methylcyclopenta-1,3-diene);2-methylfuran;3-methylfuran;bis(2-methyl-1,3-oxazole);2-methylpyrazine;3-methylpyridazine;bis(2-methylpyridine);3-methylpyridine;2-methylpyrimidine;5-methyl-3H-pyrrole;2-methyl-1,3-thiazole;2-methylthiophene;toluene
CID 157358559
N-(2-amino-2-oxoethyl)-5-propan-2-yloxypyridine-2-carboxamide;2-cyclopentylsulfonyl-5-propan-2-yloxypyridine;2-ethylsulfonyl-5-propan-2-yloxypyridine;3-fluoro-2-methyl-5-propan-2-yloxypyridine;2-isocyano-5-propan-2-yloxypyridine;2-(2-methylpropylsulfonyl)-5-propan-2-yloxypyridine;bis(2-methylsulfonyl-5-propan-2-yloxypyridine);5-propan-2-yloxy-2-(1H-pyrazol-4-yl)pyridine;2-(5-propan-2-yloxy-2-pyridinyl)-1,3-oxazole;2-(5-propan-2-yloxy-2-pyridinyl)-1,3-thiazole;5-propan-2-yloxy-2-(1H-pyrrol-2-yl)pyridine
CID 157364295
6-cyclopenta-1,4-dien-1-yl-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide;1-cyclopenta-1,3-dien-1-yl-3-(furan-2-yl)-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide;1-(2,4-diphenyl-1,3-thiazol-5-yl)-4-morpholin-4-ylbutan-1-one;4-morpholin-4-yl-N-phenyl-2-piperidin-1-yl-1,3-thiazole-5-carbothioamide;1-phenyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]-3-pyridin-3-ylpyrazole-4-carboxamide
CID 157416788
Cumene;methane;1-methyl-2-propan-2-ylimidazole;1-methyl-5-propan-2-ylimidazole;1-methyl-5-propan-2-ylpyrazole;bis(1-methyl-2-propan-2-ylpyrrole);2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-ylthiophene;4-methyl-3-propan-2-yl-1,2,4-triazole;1-methylsulfonyl-2-propan-2-ylpyrrolidine;propan-2-ylcyclohexane;bis(propan-2-ylcyclopentane);bis(3-propan-2-ylfuran);2-propan-2-yl-1,3,4-oxadiazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpiperidine;3-propan-2-ylpiperidine;4-propan-2-ylpiperidine;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyrimidine;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;bis(3-propan-2-ylthiophene)
CID 157526200

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine?
The IUPAC name of N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine (CID 167545076) is N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine.
What is the SMILES notation for N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine?
The canonical SMILES for N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine is COc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2ncco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC34CC5CC(CC(C5)C3)C4)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1.C[C@H](Nc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1ccoc1.Cn1cc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)cn1.
What is the InChIKey of N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine?
The InChIKey is BRLNEZXPTICYRI-IQFSKZNRSA-N. The full InChI is InChI=1S/C21H25N3O2S.C19H19N3O3S.C18H18N4O3S.C18H18N2O3S.C18H17NO3S2.C16H17N5O2S.2C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-27(25,26)18-4-2-17(3-5-18)19-12-22-13-20(23-19)24-21-9-14-6-15(10-21)8-16(7-14)11-21;1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(15-10-11-23-12-15)19-18-5-3-4-17(20-18)14-6-8-16(9-7-14)24(2,21)22;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-21-11-12(8-19-21)7-18-16-10-17-9-15(20-16)13-3-5-14(6-4-13)24(2,22)23;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23-16-15(11-3-5-12(6-4-11)25(2,21)22)20-13(9-19-16)18-10-14-17-7-8-24-14;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h2-5,12-16H,6-11H2,1H3,(H,23,24);3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3,(H,19,20);3-13H,1-2H3;3-6,8-11H,7H2,1-2H3,(H,18,20);3-7,9-10H,8H2,1-2H3,(H,18,20);3-9H,10H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;;2*13-;;;;;/m...01...../s1.
What are the key properties of N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine?
N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine has a molecular weight of 3565.30 g/mol, XLogP of 30.32, 53 rotatable bonds, 8 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;N-[(1S)-1-(furan-3-yl)ethyl]-6-(4-methylsulfonylphenyl)pyridin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;N-[(1-methylpyrazol-4-yl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine is sourced from PubChem (CID 167545076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).