6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

C90H67F19N30 — CID 158393714

IUPAC6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
SMILESCCc1nc2cnccc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.CCc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.CCc1ncc(C)n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.Cc1nc2ncncc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C19H13F5N6.C19H15F3N6.C18H11F5N6.C17H12F3N7.C17H16F3N5/c1-2-16-29-18-14(5-10(20)7-26-18)30(16)17-9-25-8-15(28-17)27-11-3-4-12(13(21)6-11)19(22,23)24;1-2-17-26-14-9-23-8-7-15(14)28(17)18-11-24-10-16(27-18)25-13-5-3-12(4-6-13)19(20,21)22;1-9-26-17-14(4-10(19)6-25-17)29(9)16-8-24-7-15(28-16)27-11-2-3-12(13(20)5-11)18(21,22)23;1-10-24-16-13(6-22-9-23-16)27(10)15-8-21-7-14(26-15)25-12-4-2-11(3-5-12)17(18,19)20;1-3-15-22-8-11(2)25(15)16-10-21-9-14(24-16)23-13-6-4-12(5-7-13)17(18,19)20/h3-9H,2H2,1H3,(H,27,28);3-11H,2H2,1H3,(H,25,27);2-8H,1H3,(H,27,28);2-9H,1H3,(H,25,26);4-10H,3H2,1-2H3,(H,23,24)
InChIKeyGXHBGWLINDKTEN-UHFFFAOYSA-N
MW1929.70 g/mol
LogP21.88
Rot. Bonds18

About 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine (PubChem CID 158393714) has the molecular formula C90H67F19N30 and a molecular weight of 1929.70 g/mol. Its IUPAC name is 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
PubChem CID158393714
Molecular FormulaC90H67F19N30
Molecular Weight1929.70 g/mol
Exact Mass1928.59
IUPAC Name6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
SMILESCCc1nc2cnccc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.CCc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.CCc1ncc(C)n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.Cc1nc2ncncc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C19H13F5N6.C19H15F3N6.C18H11F5N6.C17H12F3N7.C17H16F3N5/c1-2-16-29-18-14(5-10(20)7-26-18)30(16)17-9-25-8-15(28-17)27-11-3-4-12(13(21)6-11)19(22,23)24;1-2-17-26-14-9-23-8-7-15(14)28(17)18-11-24-10-16(27-18)25-13-5-3-12(4-6-13)19(20,21)22;1-9-26-17-14(4-10(19)6-25-17)29(9)16-8-24-7-15(28-16)27-11-2-3-12(13(20)5-11)18(21,22)23;1-10-24-16-13(6-22-9-23-16)27(10)15-8-21-7-14(26-15)25-12-4-2-11(3-5-12)17(18,19)20;1-3-15-22-8-11(2)25(15)16-10-21-9-14(24-16)23-13-6-4-12(5-7-13)17(18,19)20/h3-9H,2H2,1H3,(H,27,28);3-11H,2H2,1H3,(H,25,27);2-8H,1H3,(H,27,28);2-9H,1H3,(H,25,26);4-10H,3H2,1-2H3,(H,23,24)
InChIKeyGXHBGWLINDKTEN-UHFFFAOYSA-N
XLogP21.88
TPSA342.60 Ų
H-Bond Donors5
H-Bond Acceptors30
Rotatable Bonds18
Heavy Atoms139
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001929.70
LogP ≤ 521.88
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1030

Analyze 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine with MolForge

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Related Compounds

US11420970, Example 198
CID 156073186
Cyclopentyl-{4-[2-(4-fluoro-phenyl)-5-(4-methyl-piperazin-1-yl)-imidazo[4,5-b]pyridin-1-yl]-pyrimidin-2-yl}-amine
CID 9826083
{4-[(S)-2-(4-Fluoro-phenyl)-5-(4-methyl-piperazin-1-yl)-imidazo[4,5-b]pyridin-1-yl]-pyrimidin-2-yl}-(1-phenyl-ethyl)-amine
CID 9957918
N-[5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]-5-fluoro-4-(5-fluoro-1,1-dimethyl-2,3-dihydropyrrolo[1,2-a]benzimidazol-7-yl)pyrimidin-2-amine
CID 122657565
5-fluoro-4-(5-fluoro-1-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)-N-[5-[(4-propan-2-ylpiperazin-1-yl)methyl]-2-pyridinyl]pyrimidin-2-amine
CID 129102589
N-[5-[4-(dimethylamino)piperidin-1-yl]-6-fluoro-2-pyridinyl]-8-(4-methylcyclohexyl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 90654465
6-[4-[2-(3,4-difluorophenyl)ethyl]piperazin-1-yl]-8-methyl-N-(pyridin-2-ylmethyl)-3,5,8,12-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-13-amine
CID 11214464
N-[5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]-5-fluoro-4-(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)pyrimidin-2-amine
CID 122657632
6-(1-ethylpiperidin-4-yl)-N-[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]-7,8-dihydro-5H-1,6-naphthyridin-2-amine
CID 124114343
N-[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]-6-(1-propan-2-ylpiperidin-4-yl)-7,8-dihydro-5H-1,6-naphthyridin-2-amine
CID 124114458
N-[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]-6-(1-methylpiperidin-4-yl)-7,8-dihydro-5H-1,6-naphthyridin-2-amine
CID 124114467
N-[5-[(4-ethylpiperazin-1-yl)methyl]-6-methyl-2-pyridinyl]-5-fluoro-4-(5-fluoro-1,1-dimethyl-2,3-dihydropyrrolo[1,2-a]benzimidazol-7-yl)pyrimidin-2-amine
CID 129102568

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The IUPAC name of 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine (CID 158393714) is 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine.
What is the SMILES notation for 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The canonical SMILES for 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine is CCc1nc2cnccc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.CCc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.CCc1ncc(C)n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2ncc(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1.Cc1nc2ncncc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.
What is the InChIKey of 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The InChIKey is GXHBGWLINDKTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F5N6.C19H15F3N6.C18H11F5N6.C17H12F3N7.C17H16F3N5/c1-2-16-29-18-14(5-10(20)7-26-18)30(16)17-9-25-8-15(28-17)27-11-3-4-12(13(21)6-11)19(22,23)24;1-2-17-26-14-9-23-8-7-15(14)28(17)18-11-24-10-16(27-18)25-13-5-3-12(4-6-13)19(20,21)22;1-9-26-17-14(4-10(19)6-25-17)29(9)16-8-24-7-15(28-16)27-11-2-3-12(13(20)5-11)18(21,22)23;1-10-24-16-13(6-22-9-23-16)27(10)15-8-21-7-14(26-15)25-12-4-2-11(3-5-12)17(18,19)20;1-3-15-22-8-11(2)25(15)16-10-21-9-14(24-16)23-13-6-4-12(5-7-13)17(18,19)20/h3-9H,2H2,1H3,(H,27,28);3-11H,2H2,1H3,(H,25,27);2-8H,1H3,(H,27,28);2-9H,1H3,(H,25,26);4-10H,3H2,1-2H3,(H,23,24).
What are the key properties of 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine has a molecular weight of 1929.70 g/mol, XLogP of 21.88, 18 rotatable bonds, 5 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine is sourced from PubChem (CID 158393714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).