N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline

C129H98Cl2F25N29O7S2 — CID 160617440

IUPACN-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
SMILESCC1=NCC=C1CNc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.CCn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)nc1.CCn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cc(C)cc2F)nc1.Cc1cc(F)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)cn2)c(F)c1.Cc1nn(-c2nccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1F.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.O=C(Nc1ccc(-c2nc3c(cc2Cl)OCCO3)cn1)c1c(F)cccc1F
InChIInChI=1S/C20H13F3N4OS.C19H12ClF2N3O3.C19H15F5N4O.C19H16F2N6S.C18H13F5N4O.C17H13ClF4N4O.C17H16F4N4/c1-11-14(10-27(26-11)20-24-7-8-29-20)13-6-5-12(9-17(13)23)25-19(28)18-15(21)3-2-4-16(18)22;20-11-8-14-19(28-7-6-27-14)25-17(11)10-4-5-15(23-9-10)24-18(26)16-12(21)2-1-3-13(16)22;1-3-28-14(8-15(27-28)19(22,23)24)11-4-5-16(25-9-11)26-18(29)17-12(20)6-10(2)7-13(17)21;1-2-27-17(8-16(26-27)18-22-6-7-28-18)12-9-23-19(24-10-12)25-11-13-14(20)4-3-5-15(13)21;1-9-5-11(19)16(12(20)6-9)17(28)25-15-4-3-10(8-24-15)13-7-14(18(21,22)23)26-27(13)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-10-11(5-6-22-10)9-23-12-3-4-13(14(18)7-12)15-8-16(17(19,20)21)24-25(15)2/h2-10H,1H3,(H,25,28);1-5,8-9H,6-7H2,(H,23,24,26);4-9H,3H2,1-2H3,(H,25,26,29);3-10H,2,11H2,1H3,(H,23,24,25);3-8H,1-2H3,(H,24,25,28);3-8H,1-2H3,(H,23,27);3-5,7-8,23H,6,9H2,1-2H3
InChIKeyRGGUMRYXPRDBBY-UHFFFAOYSA-N
MW2776.39 g/mol
LogP31.16
Rot. Bonds27

About N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline

N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline (PubChem CID 160617440) has the molecular formula C129H98Cl2F25N29O7S2 and a molecular weight of 2776.39 g/mol. Its IUPAC name is N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline.

Molecular Properties

Compound NameN-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
PubChem CID160617440
Molecular FormulaC129H98Cl2F25N29O7S2
Molecular Weight2776.39 g/mol
Exact Mass2773.66
IUPAC NameN-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
SMILESCC1=NCC=C1CNc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.CCn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)nc1.CCn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cc(C)cc2F)nc1.Cc1cc(F)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)cn2)c(F)c1.Cc1nn(-c2nccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1F.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.O=C(Nc1ccc(-c2nc3c(cc2Cl)OCCO3)cn1)c1c(F)cccc1F
InChIInChI=1S/C20H13F3N4OS.C19H12ClF2N3O3.C19H15F5N4O.C19H16F2N6S.C18H13F5N4O.C17H13ClF4N4O.C17H16F4N4/c1-11-14(10-27(26-11)20-24-7-8-29-20)13-6-5-12(9-17(13)23)25-19(28)18-15(21)3-2-4-16(18)22;20-11-8-14-19(28-7-6-27-14)25-17(11)10-4-5-15(23-9-10)24-18(26)16-12(21)2-1-3-13(16)22;1-3-28-14(8-15(27-28)19(22,23)24)11-4-5-16(25-9-11)26-18(29)17-12(20)6-10(2)7-13(17)21;1-2-27-17(8-16(26-27)18-22-6-7-28-18)12-9-23-19(24-10-12)25-11-13-14(20)4-3-5-15(13)21;1-9-5-11(19)16(12(20)6-9)17(28)25-15-4-3-10(8-24-15)13-7-14(18(21,22)23)26-27(13)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-10-11(5-6-22-10)9-23-12-3-4-13(14(18)7-12)15-8-16(17(19,20)21)24-25(15)2/h2-10H,1H3,(H,25,28);1-5,8-9H,6-7H2,(H,23,24,26);4-9H,3H2,1-2H3,(H,25,26,29);3-10H,2,11H2,1H3,(H,23,24,25);3-8H,1-2H3,(H,24,25,28);3-8H,1-2H3,(H,23,27);3-5,7-8,23H,6,9H2,1-2H3
InChIKeyRGGUMRYXPRDBBY-UHFFFAOYSA-N
XLogP31.16
TPSA415.35 Ų
H-Bond Donors7
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms194
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002776.39
LogP ≤ 531.16
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1033

Analyze N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline with MolForge

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Related Compounds

N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;N-[4-[3-(difluoromethyl)-1-methylpyrazol-5-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
CID 157117320
N-[5-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)pyrazin-2-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-3-methylbenzamide;2,6-difluoro-N-[4-[5-methyl-2-(trifluoromethyl)-1,3-oxazol-4-yl]phenyl]benzamide;N-[5-(6-ethoxy-4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-2,6-difluoro-3-methylbenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-3-methylbenzamide;bis(N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide)
CID 157243056
6-[4-(1-Acetylpyrrolidin-2-yl)-2-(trifluoromethyl)phenyl]-2-[4-[methyl(piperidin-4-yl)amino]anilino]-8-(2-oxo-2-pyrrolidin-1-ylethyl)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(1-methylpiperidin-2-yl)phenyl]-8-(1,3-thiazol-2-ylmethyl)-2-(4-thiomorpholin-2-ylanilino)pyrido[2,3-d]pyrimidin-7-one;6-[3-chloro-5-(1-prop-1-en-2-ylpyrrolidin-3-yl)-2-pyridinyl]-2-(3-fluoro-4-piperazin-1-ylanilino)-8-(oxan-4-ylmethyl)pyrido[2,3-d]pyrimidin-7-one;6-[4-methyl-2-(1-methylpiperidin-4-yl)phenyl]-2-[4-(1-methylpyrrolidin-3-yl)oxyanilino]-8-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidin-7-one
CID 157533335
6-[2-chloro-4-(furan-3-yl)phenyl]-8-phenyl-2-(4-pyrrolidin-3-yloxyanilino)pyrido[2,3-d]pyrimidin-7-one;6-[3-chloro-5-(furan-3-yl)-2-pyridinyl]-2-(4-morpholin-2-ylanilino)-8-(2,2,2-trifluoroethyl)pyrido[2,3-d]pyrimidin-7-one;6-(2-cyclopropyl-4-methylphenyl)-8-[2-(dimethylamino)ethyl]-2-[4-(pyrrolidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-[2,6-dichloro-4-(3H-pyrrol-5-yl)phenyl]-2-[4-(1-methylpiperidin-4-yl)anilino]-8-(1,3-thiazol-2-ylmethyl)pyrido[2,3-d]pyrimidin-7-one;2-[4-(1-methylpiperidin-3-yl)anilino]-6-[4-(1,3-oxazol-5-yl)-2-(trifluoromethyl)phenyl]-8-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidin-7-one
CID 158816488
3-chloro-1-methyl-N-[4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]pyrrole-2-carboxamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluorobenzamide;N-[5-(6-ethoxy-4-methyl-3-pyridinyl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(2-ethyl-6-methyl-1,3-benzoxazol-5-yl)-2-pyridinyl]-3,5-difluoropyridine-4-carboxamide;N-[4-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]phenyl]-2-fluorobenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]pyrazin-2-yl]-2,6-difluoro-4-methylbenzamide
CID 159182905
6-(2-chloro-4-methylphenyl)-8-[[2-(oxan-4-yl)pyrazol-3-yl]methyl]-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-[[3-(cyclopenten-1-yl)imidazol-4-yl]methyl]-6-ethynyl-2-[4-(1,2,3,6-tetrahydropyridin-4-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-[(1-cyclopropylimidazol-2-yl)methyl]-2-(4-pyrrolidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;2-[4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-3-fluoroanilino]-6-[1-(oxan-4-yl)ethenyl]-8-[[2-(1,3-thiazol-2-yl)furan-3-yl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 159865203
N-[5-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)pyrazin-2-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-3-methylbenzamide;N-[(2,6-difluoro-4-methylphenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[5-(6-ethoxy-4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-2,6-difluoro-3-methylbenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-3-methylbenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide
CID 160100357
3-chloro-1-methyl-N-[4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]pyrrole-2-carboxamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluorobenzamide;N-[4-[3-(difluoromethyl)-1-methylpyrazol-5-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;N-[5-(6-ethoxy-4-methyl-3-pyridinyl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(2-ethyl-6-methyl-1,3-benzoxazol-5-yl)-2-pyridinyl]-2,6-difluorobenzamide;N-[4-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]phenyl]-2-fluorobenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]pyrazin-2-yl]-2,6-difluoro-4-methylbenzamide
CID 160117764
6-[3-Chloro-5-(1-prop-1-en-2-ylpyrrolidin-3-yl)-2-pyridinyl]-2-(3-fluoro-4-piperazin-1-ylanilino)-8-(oxan-4-ylmethyl)pyrido[2,3-d]pyrimidin-7-one;6-[3,5-dimethyl-1-(5-methylthiophen-2-yl)pyrazol-4-yl]-8-phenyl-2-(4-piperidin-4-yloxyanilino)pyrido[2,3-d]pyrimidin-7-one;6-[4-methyl-2-(1-methylpiperidin-3-yl)phenyl]-2-[4-(4-methylmorpholin-2-yl)anilino]-8-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidin-7-one;6-[5-methyl-2-(1-methylpiperidin-2-yl)-1,3-thiazol-4-yl]-2-[4-(1-methylpyrrolidin-3-yl)oxyanilino]-8-(2,2,2-trifluoroethyl)pyrido[2,3-d]pyrimidin-7-one
CID 160198972
N-[5-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)pyrazin-2-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;N-[(2,6-difluoro-4-methylphenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[5-(6-ethoxy-4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]-2,6-difluoro-3-methylbenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-3-methylbenzamide;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide
CID 160352206
6-[3-Chloro-5-(2-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]-2-[3-fluoro-4-(3-methylpiperazin-1-yl)anilino]-8-(2-morpholin-4-ylethyl)pyrido[2,3-d]pyrimidin-7-one;6-[3,5-dimethyl-1-(3-methylimidazol-4-yl)pyrazol-4-yl]-2-[4-[methyl(piperidin-3-yl)amino]anilino]-8-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidin-7-one;6-[2-fluoro-4-(2-methylpyrazol-3-yl)phenyl]-2-[4-[methyl(piperidin-4-yl)amino]anilino]-8-(2,2,2-trifluoroethyl)pyrido[2,3-d]pyrimidin-7-one;6-[5-methyl-2-(1-methylpyrrol-2-yl)-1,3-thiazol-4-yl]-2-[4-(1-methylpiperidin-3-yl)oxyanilino]-8-(1,3-thiazol-2-ylmethyl)pyrido[2,3-d]pyrimidin-7-one
CID 160400130
6-[2-Chloro-4-(furan-3-yl)phenyl]-8-phenyl-2-(4-pyrrolidin-3-yloxyanilino)pyrido[2,3-d]pyrimidin-7-one;6-[3-chloro-5-(furan-3-yl)-2-pyridinyl]-2-(4-morpholin-2-ylanilino)-8-(2,2,2-trifluoroethyl)pyrido[2,3-d]pyrimidin-7-one;methane;2-[4-(1-methylpiperidin-3-yl)anilino]-6-[4-(1,3-oxazol-5-yl)-2-(trifluoromethyl)phenyl]-8-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidin-7-one
CID 161201015

Frequently Asked Questions

What is the IUPAC name of N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline?
The IUPAC name of N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline (CID 160617440) is N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline.
What is the SMILES notation for N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline?
The canonical SMILES for N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline is CC1=NCC=C1CNc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.CCn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)nc1.CCn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cc(C)cc2F)nc1.Cc1cc(F)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)cn2)c(F)c1.Cc1nn(-c2nccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1F.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.O=C(Nc1ccc(-c2nc3c(cc2Cl)OCCO3)cn1)c1c(F)cccc1F.
What is the InChIKey of N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline?
The InChIKey is RGGUMRYXPRDBBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F3N4OS.C19H12ClF2N3O3.C19H15F5N4O.C19H16F2N6S.C18H13F5N4O.C17H13ClF4N4O.C17H16F4N4/c1-11-14(10-27(26-11)20-24-7-8-29-20)13-6-5-12(9-17(13)23)25-19(28)18-15(21)3-2-4-16(18)22;20-11-8-14-19(28-7-6-27-14)25-17(11)10-4-5-15(23-9-10)24-18(26)16-12(21)2-1-3-13(16)22;1-3-28-14(8-15(27-28)19(22,23)24)11-4-5-16(25-9-11)26-18(29)17-12(20)6-10(2)7-13(17)21;1-2-27-17(8-16(26-27)18-22-6-7-28-18)12-9-23-19(24-10-12)25-11-13-14(20)4-3-5-15(13)21;1-9-5-11(19)16(12(20)6-9)17(28)25-15-4-3-10(8-24-15)13-7-14(18(21,22)23)26-27(13)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-10-11(5-6-22-10)9-23-12-3-4-13(14(18)7-12)15-8-16(17(19,20)21)24-25(15)2/h2-10H,1H3,(H,25,28);1-5,8-9H,6-7H2,(H,23,24,26);4-9H,3H2,1-2H3,(H,25,26,29);3-10H,2,11H2,1H3,(H,23,24,25);3-8H,1-2H3,(H,24,25,28);3-8H,1-2H3,(H,23,27);3-5,7-8,23H,6,9H2,1-2H3.
What are the key properties of N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline?
N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline has a molecular weight of 2776.39 g/mol, XLogP of 31.16, 27 rotatable bonds, 7 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-2-pyridinyl]-2,6-difluorobenzamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;2,6-difluoro-N-[3-fluoro-4-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]phenyl]benzamide;2,6-difluoro-4-methyl-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[(2,6-difluorophenyl)methyl]-5-[1-ethyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrimidin-2-amine;N-[5-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline is sourced from PubChem (CID 160617440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).