4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide

C101H115BrF15N15O10 — CID 162014416

IUPAC4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(Br)c(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC(C)(C)C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccc(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC(C)(C)C)ccc1F
InChIInChI=1S/C21H23BrF3N3O2.2C21H24F3N3O2.2C19H22F3N3O2/c1-12-6-8-28(9-7-12)20(30)21(24,25)18-15(22)11-17(27(18)3)19(29)26-14-4-5-16(23)13(2)10-14;1-13-6-8-27(9-7-13)20(29)21(23,24)18-11-15(12-26(18)3)19(28)25-16-4-5-17(22)14(2)10-16;1-13-8-10-27(11-9-13)20(29)21(23,24)18-7-6-17(26(18)3)19(28)25-15-4-5-16(22)14(2)12-15;1-11-8-13(6-7-14(11)20)23-16(26)12-9-15(25(5)10-12)19(21,22)17(27)24-18(2,3)4;1-11-10-12(6-7-14(11)20)23-16(26)13-8-9-25(5)15(13)19(21,22)17(27)24-18(2,3)4/h4-5,10-12H,6-9H2,1-3H3,(H,26,29);4-5,10-13H,6-9H2,1-3H3,(H,25,28);4-7,12-13H,8-11H2,1-3H3,(H,25,28);2*6-10H,1-5H3,(H,23,26)(H,24,27)
InChIKeyYTXHUODXXPOYBX-UHFFFAOYSA-N
MW2064.00 g/mol
LogP20.45
Rot. Bonds20

About 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide

4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide (PubChem CID 162014416) has the molecular formula C101H115BrF15N15O10 and a molecular weight of 2064.00 g/mol. Its IUPAC name is 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide.

Molecular Properties

Compound Name4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
PubChem CID162014416
Molecular FormulaC101H115BrF15N15O10
Molecular Weight2064.00 g/mol
Exact Mass2061.79
IUPAC Name4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(Br)c(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC(C)(C)C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccc(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC(C)(C)C)ccc1F
InChIInChI=1S/C21H23BrF3N3O2.2C21H24F3N3O2.2C19H22F3N3O2/c1-12-6-8-28(9-7-12)20(30)21(24,25)18-15(22)11-17(27(18)3)19(29)26-14-4-5-16(23)13(2)10-14;1-13-6-8-27(9-7-13)20(29)21(23,24)18-11-15(12-26(18)3)19(28)25-16-4-5-17(22)14(2)10-16;1-13-8-10-27(11-9-13)20(29)21(23,24)18-7-6-17(26(18)3)19(28)25-15-4-5-16(22)14(2)12-15;1-11-8-13(6-7-14(11)20)23-16(26)12-9-15(25(5)10-12)19(21,22)17(27)24-18(2,3)4;1-11-10-12(6-7-14(11)20)23-16(26)13-8-9-25(5)15(13)19(21,22)17(27)24-18(2,3)4/h4-5,10-12H,6-9H2,1-3H3,(H,26,29);4-5,10-13H,6-9H2,1-3H3,(H,25,28);4-7,12-13H,8-11H2,1-3H3,(H,25,28);2*6-10H,1-5H3,(H,23,26)(H,24,27)
InChIKeyYTXHUODXXPOYBX-UHFFFAOYSA-N
XLogP20.45
TPSA289.28 Ų
H-Bond Donors7
H-Bond Acceptors15
Rotatable Bonds20
Heavy Atoms142
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002064.00
LogP ≤ 520.45
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1015

Analyze 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide with MolForge

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Related Compounds

5-[2-(cyclohexylamino)-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(1,4-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-2,4-dimethyl-5-[2-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(4-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclobutyl]amino]acetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide
CID 157750272
5-[2-(tert-butylamino)-2-oxoacetyl]-2-fluoro-N-(4-fluoro-3-isocyanophenyl)-1-methylpyrrole-3-carboxamide;N-(3-cyano-4-fluorophenyl)-1-methyl-5-[2-oxo-2-(propan-2-ylamino)acetyl]pyrrole-3-carboxamide;2-fluoro-N-(4-fluoro-3-isocyanophenyl)-1,4-dimethyl-5-[2-oxo-2-(propan-2-ylamino)acetyl]pyrrole-3-carboxamide;4-fluoro-N-(4-fluoro-3-isocyanophenyl)-1,2-dimethyl-5-[2-oxo-2-[[(2S)-1,1,1-trifluoropropan-2-yl]amino]acetyl]pyrrole-3-carboxamide;2-fluoro-N-(4-fluoro-3-isocyanophenyl)-1-methyl-5-[2-oxo-2-(propan-2-ylamino)acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-isocyanophenyl)-1-methyl-5-[2-[(1-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 158387174
N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(2R)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(3S)-2-methyl-4-oxopentan-3-yl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclohexyl]amino]acetyl]pyrrole-3-carboxamide
CID 158508290
N-(3-cyano-4-methylphenyl)-1,3-dimethyl-4-[2-oxo-2-(prop-2-ynylamino)acetyl]pyrrole-2-carboxamide;N-(3-cyano-4-methylphenyl)-3-fluoro-1-methyl-4-[2-oxo-2-(prop-2-enylamino)acetyl]pyrrole-2-carboxamide;N-(3-cyano-4-methylphenyl)-3-fluoro-1-methyl-4-[2-oxo-2-(prop-2-ynylamino)acetyl]pyrrole-2-carboxamide;N-(3-cyano-4-methylphenyl)-1-methyl-4-[2-oxo-2-(prop-2-ynylamino)acetyl]pyrrole-2-carboxamide;N-(3-fluoro-2-methyl-4-pyridinyl)-1,3,5-trimethyl-4-[2-oxo-2-(prop-2-enylamino)acetyl]pyrrole-2-carboxamide;N-(3-fluoro-2-methyl-4-pyridinyl)-1,3,5-trimethyl-4-[2-oxo-2-(prop-2-ynylamino)acetyl]pyrrole-2-carboxamide;1,3,5-trimethyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-4-(2-oxohex-5-enoyl)pyrrole-2-carboxamide;1,3,5-trimethyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-4-[2-oxo-2-(prop-2-ynylamino)acetyl]pyrrole-2-carboxamide
CID 158610009
5-[2-[(1,4-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(6-fluoro-3-pyridinyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(3-fluoro-1,3-dimethylcyclobutyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1S,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclobutyl]amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetyl]pyrrole-3-carboxamide;N-(6-fluoro-3-pyridinyl)-1,2,4-trimethyl-5-[2-[[4-methyl-4-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 159928115
5-[2-[[(2S)-butan-2-yl]amino]-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,2-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-oxo-2-(propan-2-ylamino)ethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
CID 160725069
N-(3-chloro-4-fluorophenyl)-1,2,4-trimethyl-5-[2-[(4-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;5-[2-[(1,4-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(6-fluoro-3-pyridinyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(4-fluoro-4-methylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(4-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-3-pyridinyl)-1,2,4-trimethyl-5-[2-[[4-methyl-4-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 160741731
5-[2-[(1-ethyl-3,3-difluorocyclobutyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-2,4-dimethyl-5-[2-[(5-methyl-2-adamantyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-2,4-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-1,2,4-trimethyl-5-[2-[(3-methyl-1-adamantyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-1,2,4-trimethyl-5-[2-[(5-methyl-2-adamantyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-3-pyridinyl)-1,2,4-trimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]pyrrole-3-carboxamide
CID 161415410
5-[2-[[(2R)-butan-2-yl]amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-(cyclohexylamino)-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;1-(2-fluoroethyl)-N-(6-fluoro-5-methyl-3-pyridinyl)-2,4-dimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]pyrrole-3-carboxamide;bis(N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(2-methylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide);N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[4-methyl-4-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 161800579
5-[2-(tert-butylamino)-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(3,3-difluoro-2-methylbutan-2-yl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(1-ethylcyclopropyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1-methyl-5-(2-oxopropanoyl)pyrrole-3-carboxamide;bis(N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(2-methylbutan-2-ylamino)-2-oxoacetyl]pyrrole-3-carboxamide)
CID 161872811
2-[2-[[(2R)-butan-2-yl]amino]-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;2-[2-[[(2S)-butan-2-yl]amino]-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-[[(2R)-butan-2-yl]amino]-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-(3,3-difluorobutan-2-ylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
CID 161915437
5-[2-[[(2S)-butan-2-yl]amino]-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-oxo-2-(propan-2-ylamino)ethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
CID 163413670

Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The IUPAC name of 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide (CID 162014416) is 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide.
What is the SMILES notation for 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The canonical SMILES for 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide is Cc1cc(NC(=O)c2cc(Br)c(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC(C)(C)C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccc(C(F)(F)C(=O)N3CCC(C)CC3)n2C)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC(C)(C)C)ccc1F.
What is the InChIKey of 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The InChIKey is YTXHUODXXPOYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23BrF3N3O2.2C21H24F3N3O2.2C19H22F3N3O2/c1-12-6-8-28(9-7-12)20(30)21(24,25)18-15(22)11-17(27(18)3)19(29)26-14-4-5-16(23)13(2)10-14;1-13-6-8-27(9-7-13)20(29)21(23,24)18-11-15(12-26(18)3)19(28)25-16-4-5-17(22)14(2)10-16;1-13-8-10-27(11-9-13)20(29)21(23,24)18-7-6-17(26(18)3)19(28)25-15-4-5-16(22)14(2)12-15;1-11-8-13(6-7-14(11)20)23-16(26)12-9-15(25(5)10-12)19(21,22)17(27)24-18(2,3)4;1-11-10-12(6-7-14(11)20)23-16(26)13-8-9-25(5)15(13)19(21,22)17(27)24-18(2,3)4/h4-5,10-12H,6-9H2,1-3H3,(H,26,29);4-5,10-13H,6-9H2,1-3H3,(H,25,28);4-7,12-13H,8-11H2,1-3H3,(H,25,28);2*6-10H,1-5H3,(H,23,26)(H,24,27).
What are the key properties of 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide has a molecular weight of 2064.00 g/mol, XLogP of 20.45, 20 rotatable bonds, 7 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;2-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[2-(tert-butylamino)-1,1-difluoro-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-2-carboxamide;5-[1,1-difluoro-2-(4-methylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide is sourced from PubChem (CID 162014416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).