5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide

C117H111FN20O19S10 — CID 167618756

IUPAC5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide
SMILESCS(=O)(=O)c1ccc(-c2cccc(NCc3ccco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cnc(C(N)=O)c(NCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(/C=C/c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC[C@@H]3CCCO3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2nc(NCc3ccco3)ccc2F)cc1.Cc1ccc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)nc1
InChIInChI=1S/C18H18N4O2S.C17H15FN2O3S.C17H16N4O3S2.C17H16N2O3S.C17H14N2O2S2.C16H19N3O3S.C15H13N3O3S2/c1-13-3-6-15(20-9-13)10-21-18-12-19-11-17(22-18)14-4-7-16(8-5-14)25(2,23)24;1-24(21,22)14-6-4-12(5-7-14)17-15(18)8-9-16(20-17)19-11-13-3-2-10-23-13;1-26(23,24)13-6-4-11(5-7-13)14-10-19-15(16(18)22)17(21-14)20-9-12-3-2-8-25-12;1-23(20,21)15-9-7-13(8-10-15)16-5-2-6-17(19-16)18-12-14-4-3-11-22-14;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23(20,21)14-6-4-12(5-7-14)15-10-17-11-16(19-15)18-9-13-3-2-8-22-13;1-23(19,20)12-4-2-11(3-5-12)13-8-16-9-15(18-13)22-10-14-17-6-7-21-14/h3-9,11-12H,10H2,1-2H3,(H,21,22);2-10H,11H2,1H3,(H,19,20);2-8,10H,9H2,1H3,(H2,18,22)(H,20,21);2-11H,12H2,1H3,(H,18,19);2-12H,1H3;4-7,10-11,13H,2-3,8-9H2,1H3,(H,18,19);2-9H,10H2,1H3/b;;;;7-6+;;/t;;;;;13-;/m.....0./s1
InChIKeyMDBJXDHNVHOBPS-NXRRYIQMSA-N
MW2440.96 g/mol
LogP20.78
Rot. Bonds35

About 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide

5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide (PubChem CID 167618756) has the molecular formula C117H111FN20O19S10 and a molecular weight of 2440.96 g/mol. Its IUPAC name is 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide
PubChem CID167618756
Molecular FormulaC117H111FN20O19S10
Molecular Weight2440.96 g/mol
Exact Mass2438.55
IUPAC Name5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide
SMILESCS(=O)(=O)c1ccc(-c2cccc(NCc3ccco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cnc(C(N)=O)c(NCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(/C=C/c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC[C@@H]3CCCO3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2nc(NCc3ccco3)ccc2F)cc1.Cc1ccc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)nc1
InChIInChI=1S/C18H18N4O2S.C17H15FN2O3S.C17H16N4O3S2.C17H16N2O3S.C17H14N2O2S2.C16H19N3O3S.C15H13N3O3S2/c1-13-3-6-15(20-9-13)10-21-18-12-19-11-17(22-18)14-4-7-16(8-5-14)25(2,23)24;1-24(21,22)14-6-4-12(5-7-14)17-15(18)8-9-16(20-17)19-11-13-3-2-10-23-13;1-26(23,24)13-6-4-11(5-7-13)14-10-19-15(16(18)22)17(21-14)20-9-12-3-2-8-25-12;1-23(20,21)15-9-7-13(8-10-15)16-5-2-6-17(19-16)18-12-14-4-3-11-22-14;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23(20,21)14-6-4-12(5-7-14)15-10-17-11-16(19-15)18-9-13-3-2-8-22-13;1-23(19,20)12-4-2-11(3-5-12)13-8-16-9-15(18-13)22-10-14-17-6-7-21-14/h3-9,11-12H,10H2,1-2H3,(H,21,22);2-10H,11H2,1H3,(H,19,20);2-8,10H,9H2,1H3,(H2,18,22)(H,20,21);2-11H,12H2,1H3,(H,18,19);2-12H,1H3;4-7,10-11,13H,2-3,8-9H2,1H3,(H,18,19);2-9H,10H2,1H3/b;;;;7-6+;;/t;;;;;13-;/m.....0./s1
InChIKeyMDBJXDHNVHOBPS-NXRRYIQMSA-N
XLogP20.78
TPSA571.33 Ų
H-Bond Donors6
H-Bond Acceptors41
Rotatable Bonds35
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002440.96
LogP ≤ 520.78
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1041

Analyze 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide with MolForge

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Related Compounds

2-(furan-2-ylmethoxy)-6-(4-methylsulfonylphenyl)pyrazine;3-methyl-6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)pyrazin-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-(1,2-thiazol-5-ylmethyl)pyrazin-2-amine;2-(4-methylsulfonylphenyl)-6-(thiophen-2-ylmethoxy)pyrazine;6-(4-methylsulfonylphenyl)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)pyrazin-2-amine;6-(6-methylsulfonyl-3-pyridinyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 167559019
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
N-(1,1-dioxothiolan-3-yl)-2-(4-ethylphenyl)-N-(furan-3-ylmethyl)-4-methyl-1,3-thiazole-5-carboxamide;N-[2-(N-ethyl-2-methylanilino)ethyl]-4-methyl-2-phenyl-1,3-oxazole-5-carboxamide;1-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]-4-(N-methylanilino)butan-1-one;4-methyl-N-(3-pyrazin-2-ylpropyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;4-methyl-2-pyridin-2-yl-N-(3-pyrimidin-2-ylpropyl)-1,3-thiazole-5-carboxamide;(4-phenylpiperidin-1-yl)-(2-phenyl-1,3-thiazol-5-yl)methanone
CID 157861504
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;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 157862214
N-(1,1-dioxothiolan-3-yl)-2-(4-ethylphenyl)-N-(furan-3-ylmethyl)-4-methyl-1,3-thiazole-5-carboxamide;N-[2-(N-ethyl-2-methylanilino)ethyl]-4-methyl-2-phenyl-1,3-oxazole-5-carboxamide;2-(4-fluorophenyl)-4-methyl-N-[2-(N-methylanilino)ethyl]-1,3-thiazole-5-carboxamide;4-methyl-N-[2-(pyrazin-2-ylamino)ethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;4-methyl-2-pyridin-2-yl-N-[2-(pyrimidin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide;(4-phenylpiperidin-1-yl)-(2-phenyl-1,3-thiazol-5-yl)methanone
CID 157938902
[4-Amino-2-[[1-[[6-[2-(dimethylamino)ethylsulfanyl]-3-pyridinyl]sulfonyl]piperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;[4-amino-2-[[1-[[6-[1-(dimethylamino)propan-2-yloxy]-3-pyridinyl]sulfonyl]piperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;[4-amino-2-[[1-[[6-[3-(dimethylamino)prop-1-ynyl]-3-pyridinyl]sulfonyl]piperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;[4-amino-2-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;[4-amino-2-[[1-[[6-(1-methylimidazol-4-yl)-3-pyridinyl]sulfonyl]piperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;[4-amino-2-[[1-(4-pyridin-3-ylphenyl)sulfonylpiperidin-4-yl]amino]-1,3-thiazol-5-yl]-(2,6-difluorophenyl)methanone;methane
CID 158022289
N,4-dimethylbenzamide;N,N-dimethyl-2-(4-methylphenyl)acetamide;2,3-dimethyl-5-methylsulfonylpyridine;4,5-dimethyl-1,3-oxazole;(3,4-dimethylphenyl)-methyl-methylidene-oxo-lambda6-sulfane;1,2-dimethylpyrrole;2-ethoxy-5-methylpyridine;N-ethyl-4-methylbenzamide;2-ethyl-1-methylimidazole;methyl-methylidene-(4-methylphenyl)-oxo-lambda6-sulfane;1-methyl-4-(methylsulfonylmethyl)benzene;2-methyl-5-methylsulfonylpyridine;5-methyl-2-methylsulfonylpyridine;5-methyl-1,3-oxazole;2-(4-methylphenyl)acetamide;2-(4-methylphenyl)acetonitrile;1-(4-methylphenyl)butan-2-one;1-(4-methylphenyl)ethanone;3-methylpyridine;1-methylpyrrole;toluene;1,4-xylene
CID 158149845
N-(3,3-dimethylbut-1-en-2-yl)-N-methylpyridin-2-amine;2,2-dimethyl-N-(1-phenylcyclopropyl)propanamide;2,2-dimethyl-N-(1-phenylethyl)propanamide;2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide;2,2-dimethyl-N-[(1S)-1-phenylethyl]propanamide;2,2-dimethyl-N-phenylpropanamide;2,2-dimethyl-N-(1-pyridin-3-ylcyclopropyl)propanamide;2,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide;2,2-dimethyl-N-(1-pyridin-2-ylpropyl)propanamide;2,2-dimethyl-N-(1H-pyrrol-2-ylmethyl)propanamide;2,2-dimethyl-N-(2-thiophen-2-ylethyl)propanamide;3,3-dimethyl-N-(thiophen-2-ylmethyl)but-1-en-2-amine;2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;N-[(2-fluorophenyl)methyl]-2,2-dimethylpropanamide;N-(furan-2-ylmethyl)-2,2-dimethylpropanamide
CID 158212678
cumene;bis(2-propan-2-ylfuran);2-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);2-propan-2-ylpyrazine;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;bis(2-propan-2-yl-1H-pyrrole);5-propan-2-yl-2H-pyrrole;5-propan-2-yl-3H-pyrrole;tris(2-propan-2-yl-1,3-thiazole);bis(2-propan-2-ylthiophene)
CID 158260533
N-[4-(5-benzoyl-3-methylthiophen-2-yl)phenyl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-[2-(2-hydroxypropan-2-yl)-5-pyridin-3-ylthiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-2-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[4-[3-methyl-5-(pyridine-3-carbonyl)thiophen-2-yl]phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(2-pyridin-3-ylethyl)thiophen-3-yl]phenyl]benzamide;2,6-difluoro-N-[4-[3-methyl-5-(pyridin-3-ylmethyl)thiophen-2-yl]phenyl]benzamide;2,6-difluoro-N-[5-(2-methyl-5-pyridin-3-ylthiophen-3-yl)pyrazin-2-yl]benzamide
CID 158417219

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide?
The IUPAC name of 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide (CID 167618756) is 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide?
The canonical SMILES for 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide is CS(=O)(=O)c1ccc(-c2cccc(NCc3ccco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cnc(C(N)=O)c(NCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(/C=C/c3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(NC[C@@H]3CCCO3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2nc(NCc3ccco3)ccc2F)cc1.Cc1ccc(CNc2cncc(-c3ccc(S(C)(=O)=O)cc3)n2)nc1.
What is the InChIKey of 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide?
The InChIKey is MDBJXDHNVHOBPS-NXRRYIQMSA-N. The full InChI is InChI=1S/C18H18N4O2S.C17H15FN2O3S.C17H16N4O3S2.C17H16N2O3S.C17H14N2O2S2.C16H19N3O3S.C15H13N3O3S2/c1-13-3-6-15(20-9-13)10-21-18-12-19-11-17(22-18)14-4-7-16(8-5-14)25(2,23)24;1-24(21,22)14-6-4-12(5-7-14)17-15(18)8-9-16(20-17)19-11-13-3-2-10-23-13;1-26(23,24)13-6-4-11(5-7-13)14-10-19-15(16(18)22)17(21-14)20-9-12-3-2-8-25-12;1-23(20,21)15-9-7-13(8-10-15)16-5-2-6-17(19-16)18-12-14-4-3-11-22-14;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23(20,21)14-6-4-12(5-7-14)15-10-17-11-16(19-15)18-9-13-3-2-8-22-13;1-23(19,20)12-4-2-11(3-5-12)13-8-16-9-15(18-13)22-10-14-17-6-7-21-14/h3-9,11-12H,10H2,1-2H3,(H,21,22);2-10H,11H2,1H3,(H,19,20);2-8,10H,9H2,1H3,(H2,18,22)(H,20,21);2-11H,12H2,1H3,(H,18,19);2-12H,1H3;4-7,10-11,13H,2-3,8-9H2,1H3,(H,18,19);2-9H,10H2,1H3/b;;;;7-6+;;/t;;;;;13-;/m.....0./s1.
What are the key properties of 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide?
5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide has a molecular weight of 2440.96 g/mol, XLogP of 20.78, 35 rotatable bonds, 6 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-(furan-2-ylmethyl)-6-(4-methylsulfonylphenyl)pyridin-2-amine;N-[(5-methyl-2-pyridinyl)methyl]-6-(4-methylsulfonylphenyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazin-2-amine;2-[[6-(4-methylsulfonylphenyl)pyrazin-2-yl]sulfanylmethyl]-1,3-oxazole;2-(4-methylsulfonylphenyl)-6-[(E)-2-thiophen-2-ylethenyl]pyrazine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 167618756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).