2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide

C108H128F15N15O11 — CID 158201456

IUPAC2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
SMILESCCC(C)(C)NC(=O)C(F)(F)c1c(C)c(C(=O)Nc2ccc(F)c(C)c2)cn1C.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N[C@@H]3CCCC[C@H]3C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC2CCC(O)CC2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1F
InChIInChI=1S/3C22H26F3N3O2.C21H24F3N3O3.C21H26F3N3O2/c1-13-4-6-16(7-5-13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-17-8-9-18(23)14(2)10-17;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-16-8-9-17(23)14(2)10-16;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-16(10-11-28(19)3)20(29)26-15-8-9-17(23)14(2)12-15;1-12-11-14(5-8-17(12)22)25-19(29)16-9-10-27(2)18(16)21(23,24)20(30)26-13-3-6-15(28)7-4-13;1-7-20(4,5)26-19(29)21(23,24)17-13(3)15(11-27(17)6)18(28)25-14-8-9-16(22)12(2)10-14/h8-13,16H,4-7H2,1-3H3,(H,26,29)(H,27,30);2*8-13,18H,4-7H2,1-3H3,(H,26,29)(H,27,30);5,8-11,13,15,28H,3-4,6-7H2,1-2H3,(H,25,29)(H,26,30);8-11H,7H2,1-6H3,(H,25,28)(H,26,29)/t;2*13-,18-;;/m.11../s1
InChIKeyGAZHQWXYQLNXEC-NTPMDASKSA-N
MW2097.28 g/mol
LogP21.20
Rot. Bonds26

About 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide

2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide (PubChem CID 158201456) has the molecular formula C108H128F15N15O11 and a molecular weight of 2097.28 g/mol. Its IUPAC name is 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide.

Molecular Properties

Compound Name2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
PubChem CID158201456
Molecular FormulaC108H128F15N15O11
Molecular Weight2097.28 g/mol
Exact Mass2095.97
IUPAC Name2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide
SMILESCCC(C)(C)NC(=O)C(F)(F)c1c(C)c(C(=O)Nc2ccc(F)c(C)c2)cn1C.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N[C@@H]3CCCC[C@H]3C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC2CCC(O)CC2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1F
InChIInChI=1S/3C22H26F3N3O2.C21H24F3N3O3.C21H26F3N3O2/c1-13-4-6-16(7-5-13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-17-8-9-18(23)14(2)10-17;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-16-8-9-17(23)14(2)10-16;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-16(10-11-28(19)3)20(29)26-15-8-9-17(23)14(2)12-15;1-12-11-14(5-8-17(12)22)25-19(29)16-9-10-27(2)18(16)21(23,24)20(30)26-13-3-6-15(28)7-4-13;1-7-20(4,5)26-19(29)21(23,24)17-13(3)15(11-27(17)6)18(28)25-14-8-9-16(22)12(2)10-14/h8-13,16H,4-7H2,1-3H3,(H,26,29)(H,27,30);2*8-13,18H,4-7H2,1-3H3,(H,26,29)(H,27,30);5,8-11,13,15,28H,3-4,6-7H2,1-2H3,(H,25,29)(H,26,30);8-11H,7H2,1-6H3,(H,25,28)(H,26,29)/t;2*13-,18-;;/m.11../s1
InChIKeyGAZHQWXYQLNXEC-NTPMDASKSA-N
XLogP21.20
TPSA335.88 Ų
H-Bond Donors11
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms149
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002097.28
LogP ≤ 521.20
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1016

Analyze 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-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-(3-fluoro-4-methylanilino)-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-(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
CID 157301306
5-[2-[(1,4-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;bis(5-[2-[(4,4-dimethylcyclohexyl)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-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[4-methyl-4-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 157419181
5-[2-(cyclohexylamino)-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]-1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-2,4-dimethylpyrrole-3-carboxamide;5-[2-[(1,4-dimethylcyclohexyl)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-(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 157599813
5-[2-[[3-fluoro-3-methyl-1-(methylcarbamoyl)cyclobutyl]amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;(2R)-2-[[2-[4-[(4-fluoro-3-methylphenyl)carbamoyl]-1,3,5-trimethylpyrrol-2-yl]-2-oxoacetyl]amino]-3-methylbutanoic acid;N-(4-fluoro-3-methylphenyl)-5-[2-[[(2R)-1-hydroxy-3-methylbutan-2-yl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclohexyl]amino]acetyl]pyrrole-3-carboxamide;N-(6-fluoro-3-pyridinyl)-1,2,4-trimethyl-5-[2-oxo-2-[[1-(trifluoromethyl)cyclohexyl]amino]acetyl]pyrrole-3-carboxamide
CID 158024469
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-[(2S)-2-hydroxypropyl]-3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;N-[(2S)-2-hydroxypropyl]-3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-propan-2-yl-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-propan-2-yl-1H-indole-6-carboxamide;3-[(2R)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]-1H-indole-6-carboxamide;3-[(2S)-2-[2-(4-methylphenyl)ethylamino]-2-phenylacetyl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]-1H-indole-6-carboxamide
CID 159037192
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
5-[2-[(2,2-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;1-ethyl-N-(4-fluoro-3-methylphenyl)-2,4-dimethyl-5-[2-[(4-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;5-[2-[(4-ethynylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[4-(1-hydroxyethenyl)cyclohexyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[1-(hydroxymethyl)cyclohexyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[4-methyl-1-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 160871694
5-[2-[(4-acetylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[(2,2-dimethylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;1-ethyl-N-(4-fluoro-3-methylphenyl)-2,4-dimethyl-5-[2-[(4-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;5-[2-[(4-ethynylcyclohexyl)amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[1-(hydroxymethyl)cyclohexyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[4-methyl-1-(trifluoromethyl)cyclohexyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide
CID 161433750
5-[2-[[(2S)-butan-2-yl]amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-3-carboxamide;5-[2-[[(2R)-butan-2-yl]amino]-2-oxoacetyl]-N-(4-fluoro-3-methylphenyl)-1,2,4-trimethylpyrrole-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 161700268
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

Frequently Asked Questions

What is the IUPAC name of 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The IUPAC name of 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide (CID 158201456) is 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide.
What is the SMILES notation for 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The canonical SMILES for 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide is CCC(C)(C)NC(=O)C(F)(F)c1c(C)c(C(=O)Nc2ccc(F)c(C)c2)cn1C.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)NC3CCC(C)CC3)n(C)c2)ccc1F.Cc1cc(NC(=O)c2cc(C(F)(F)C(=O)N[C@@H]3CCCC[C@H]3C)n(C)c2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)NC2CCC(O)CC2)ccc1F.Cc1cc(NC(=O)c2ccn(C)c2C(F)(F)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1F.
What is the InChIKey of 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
The InChIKey is GAZHQWXYQLNXEC-NTPMDASKSA-N. The full InChI is InChI=1S/3C22H26F3N3O2.C21H24F3N3O3.C21H26F3N3O2/c1-13-4-6-16(7-5-13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-17-8-9-18(23)14(2)10-17;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-11-15(12-28(19)3)20(29)26-16-8-9-17(23)14(2)10-16;1-13-6-4-5-7-18(13)27-21(30)22(24,25)19-16(10-11-28(19)3)20(29)26-15-8-9-17(23)14(2)12-15;1-12-11-14(5-8-17(12)22)25-19(29)16-9-10-27(2)18(16)21(23,24)20(30)26-13-3-6-15(28)7-4-13;1-7-20(4,5)26-19(29)21(23,24)17-13(3)15(11-27(17)6)18(28)25-14-8-9-16(22)12(2)10-14/h8-13,16H,4-7H2,1-3H3,(H,26,29)(H,27,30);2*8-13,18H,4-7H2,1-3H3,(H,26,29)(H,27,30);5,8-11,13,15,28H,3-4,6-7H2,1-2H3,(H,25,29)(H,26,30);8-11H,7H2,1-6H3,(H,25,28)(H,26,29)/t;2*13-,18-;;/m.11../s1.
What are the key properties of 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide?
2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide has a molecular weight of 2097.28 g/mol, XLogP of 21.20, 26 rotatable bonds, 11 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1,1-difluoro-2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1,4-dimethylpyrrole-3-carboxamide;2-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide;5-[1,1-difluoro-2-[(4-methylcyclohexyl)amino]-2-oxoethyl]-N-(4-fluoro-3-methylphenyl)-1-methylpyrrole-3-carboxamide is sourced from PubChem (CID 158201456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).