About 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate
2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate (PubChem CID 162190867) has the molecular formula C135H148F16IN33O20+2
and a molecular weight of 2983.75 g/mol. Its IUPAC name is 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate.
Frequently Asked Questions
What is the IUPAC name of 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate?
The IUPAC name of 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate (CID 162190867) is 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate.
What is the SMILES notation for 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate?
The canonical SMILES for 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate is C.CC(=O)N(C(=O)Oc1ccccc1)c1nc(-c2ccc(F)cc2F)ccc1[N+](=O)[O-].CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1.CCI.CCn1cc2c(n1)CN(C(=O)Cc1nc(-c3ccc(F)cc3F)ccc1N)C2.CCn1cc2c(n1)CN(C(=O)Cc1nc(-c3ccc(F)cc3F)ccc1[N+](=O)[O-])C2.CCn1cc2c(n1)CN(C(=O)OC(C)(C)C)C2.CCn1cc2c(n1)C[N+](F)(C(=O)C(F)(F)F)C2.CCn1ncc2c1CN(C(=O)Cc1nc(-c3ccc(F)cc3F)ccc1[N+](=O)[O-])C2.CCn1ncc2c1CN(C(=O)OC(C)(C)C)C2.CCn1ncc2c1C[N+](F)(C(=O)C(F)(F)F)C2.
What is the InChIKey of 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate?
The InChIKey is ILNYNLLUWHLBTD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H17F2N5O3.C20H19F2N5O.C20H13F2N3O5.2C12H19N3O2.C10H15N3O2.2C9H10F4N3O.C2H5I.CH4/c1-2-26-10-12-9-25(11-18(12)24-26)20(28)8-17-19(27(29)30)6-5-16(23-17)14-4-3-13(21)7-15(14)22;1-2-26-19-11-25(10-12(19)9-23-26)20(28)8-17-18(27(29)30)6-5-16(24-17)14-4-3-13(21)7-15(14)22;1-2-27-10-12-9-26(11-19(12)25-27)20(28)8-18-16(23)5-6-17(24-18)14-4-3-13(21)7-15(14)22;1-12(26)24(20(27)30-14-5-3-2-4-6-14)19-18(25(28)29)10-9-17(23-19)15-8-7-13(21)11-16(15)22;1-5-15-7-9-6-14(8-10(9)13-15)11(16)17-12(2,3)4;1-5-15-10-8-14(7-9(10)6-13-15)11(16)17-12(2,3)4;1-10(2,3)15-9(14)13-5-7-4-11-12-8(7)6-13;1-2-15-3-6-4-16(13,5-7(6)14-15)8(17)9(10,11)12;1-2-15-7-5-16(13,4-6(7)3-14-15)8(17)9(10,11)12;1-2-3;/h3-7,10H,2,8-9,11H2,1H3;3-7,9H,2,8,10-11H2,1H3;3-7,10H,2,8-9,11,23H2,1H3;2-11H,1H3;7H,5-6,8H2,1-4H3;6H,5,7-8H2,1-4H3;4H,5-6H2,1-3H3,(H,11,12);2*3H,2,4-5H2,1H3;2H2,1H3;1H4/q;;;;;;;2*+1;;.
What are the key properties of 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate?
2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate has a molecular weight of 2983.75 g/mol, XLogP of 25.33, 22 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;tert-butyl 4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxylate;tert-butyl 2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxylate;tert-butyl 1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(2-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)ethanone;2-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]-1-(1-ethyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)ethanone;1-(2-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-c]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;1-(1-ethyl-5-fluoro-4,6-dihydropyrrolo[3,4-d]pyrazol-5-ium-5-yl)-2,2,2-trifluoroethanone;iodoethane;methane;phenyl N-acetyl-N-[6-(2,4-difluorophenyl)-3-nitro-2-pyridinyl]carbamate is sourced from PubChem (CID 162190867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).