About 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide
4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide (PubChem CID 160548223) has the molecular formula C120H115Cl5F22N18O20
and a molecular weight of 2724.57 g/mol. Its IUPAC name is 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide.
Frequently Asked Questions
What is the IUPAC name of 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide?
The IUPAC name of 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide (CID 160548223) is 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide?
The canonical SMILES for 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide is CCC(C)(C)NC(=O)C(=O)c1c(Cl)c(C(=O)Nc2cc(F)c(F)c(F)c2)c(C)n1C.COc1c(C(=O)Nc2ccc(F)c(F)c2)c(C)n(C)c1C(=O)C(=O)NC1(C(F)(F)F)CC1.Cc1c(C(=O)Nc2cc(F)c(F)c(F)c2)c(Cl)c(C(=O)C(=O)NCC(C)(C)C)n1C.Cc1c(C(=O)Nc2cc(F)c(F)c(F)c2)c(Cl)c(C(=O)C(=O)N[C@@H]2CCC[C@@H]2O)n1C.Cc1c(C(=O)Nc2ccc(F)c(F)c2)c(Cl)c(C(=O)C(=O)NC2(C(F)(F)F)CC2)n1C.Cc1c(C(=O)Nc2ccc(F)c(F)c2)c(Cl)c(C(=O)C(=O)NC2(C)CC(C)(F)C2)n1C.
What is the InChIKey of 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide?
The InChIKey is QXSCTHPRFBTERZ-RSIVKGLUSA-N. The full InChI is InChI=1S/C21H21ClF3N3O3.C20H19ClF3N3O4.2C20H21ClF3N3O3.C20H18F5N3O4.C19H15ClF5N3O3/c1-10-14(18(30)26-11-5-6-12(23)13(24)7-11)15(22)16(28(10)4)17(29)19(31)27-21(3)8-20(2,25)9-21;1-8-14(19(30)25-9-6-10(22)16(24)11(23)7-9)15(21)17(27(8)2)18(29)20(31)26-12-4-3-5-13(12)28;1-9-13(18(29)26-10-6-11(22)15(24)12(23)7-10)14(21)16(27(9)5)17(28)19(30)25-8-20(2,3)4;1-6-20(3,4)26-19(30)17(28)16-14(21)13(9(2)27(16)5)18(29)25-10-7-11(22)15(24)12(23)8-10;1-9-13(17(30)26-10-4-5-11(21)12(22)8-10)16(32-3)14(28(9)2)15(29)18(31)27-19(6-7-19)20(23,24)25;1-8-12(16(30)26-9-3-4-10(21)11(22)7-9)13(20)14(28(8)2)15(29)17(31)27-18(5-6-18)19(23,24)25/h5-7H,8-9H2,1-4H3,(H,26,30)(H,27,31);6-7,12-13,28H,3-5H2,1-2H3,(H,25,30)(H,26,31);6-7H,8H2,1-5H3,(H,25,30)(H,26,29);7-8H,6H2,1-5H3,(H,25,29)(H,26,30);4-5,8H,6-7H2,1-3H3,(H,26,30)(H,27,31);3-4,7H,5-6H2,1-2H3,(H,26,30)(H,27,31)/t;12-,13+;;;;/m.1..../s1.
What are the key properties of 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide?
4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide has a molecular weight of 2724.57 g/mol, XLogP of 22.29, 32 rotatable bonds, 13 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3,4-difluorophenyl)-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;4-chloro-N-(3,4-difluorophenyl)-5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-1,2-dimethylpyrrole-3-carboxamide;4-chloro-1,2-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-(2,2-dimethylpropylamino)-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;4-chloro-5-[2-[[(1R,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2-dimethyl-N-(3,4,5-trifluorophenyl)pyrrole-3-carboxamide;N-(3,4-difluorophenyl)-4-methoxy-1,2-dimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide is sourced from PubChem (CID 160548223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).