1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide

C132H157F7N20O22 — CID 162203631

IUPAC1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide
SMILESCc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3CC(C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CCC[C@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CC[C@@H](C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(CCF)c2C)ccc1F
InChIInChI=1S/C23H27F2N3O4.C23H28FN3O3.C22H26FN3O4.C22H26FN3O3.2C21H25FN4O4/c1-12-11-15(7-8-16(12)25)26-22(31)19-13(2)20(28(10-9-24)14(19)3)21(30)23(32)27-17-5-4-6-18(17)29;1-12-6-7-16(10-12)26-23(30)21(28)20-14(3)19(15(4)27(20)5)22(29)25-17-8-9-18(24)13(2)11-17;1-11-10-14(8-9-15(11)23)24-21(29)18-12(2)19(26(4)13(18)3)20(28)22(30)25-16-6-5-7-17(16)27;1-11-8-16(9-11)25-22(29)20(27)19-13(3)18(14(4)26(19)5)21(28)24-15-6-7-17(23)12(2)10-15;2*1-10-8-13(9-23-19(10)22)24-20(29)16-11(2)17(26(4)12(16)3)18(28)21(30)25-14-6-5-7-15(14)27/h7-8,11,17-18,29H,4-6,9-10H2,1-3H3,(H,26,31)(H,27,32);8-9,11-12,16H,6-7,10H2,1-5H3,(H,25,29)(H,26,30);8-10,16-17,27H,5-7H2,1-4H3,(H,24,29)(H,25,30);6-7,10-11,16H,8-9H2,1-5H3,(H,24,28)(H,25,29);2*8-9,14-15,27H,5-7H2,1-4H3,(H,24,29)(H,25,30)/t17-,18-;12-,16-;16-,17-;;2*14-,15-/m010.10/s1
InChIKeyZRXFMOHDBAZXSL-APWJFZMTSA-N
MW2508.81 g/mol
LogP16.71
Rot. Bonds32

About 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide

1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide (PubChem CID 162203631) has the molecular formula C132H157F7N20O22 and a molecular weight of 2508.81 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide.

Molecular Properties

Compound Name1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide
PubChem CID162203631
Molecular FormulaC132H157F7N20O22
Molecular Weight2508.81 g/mol
Exact Mass2507.17
IUPAC Name1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide
SMILESCc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3CC(C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CCC[C@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CC[C@@H](C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(CCF)c2C)ccc1F
InChIInChI=1S/C23H27F2N3O4.C23H28FN3O3.C22H26FN3O4.C22H26FN3O3.2C21H25FN4O4/c1-12-11-15(7-8-16(12)25)26-22(31)19-13(2)20(28(10-9-24)14(19)3)21(30)23(32)27-17-5-4-6-18(17)29;1-12-6-7-16(10-12)26-23(30)21(28)20-14(3)19(15(4)27(20)5)22(29)25-17-8-9-18(24)13(2)11-17;1-11-10-14(8-9-15(11)23)24-21(29)18-12(2)19(26(4)13(18)3)20(28)22(30)25-16-6-5-7-17(16)27;1-11-8-16(9-11)25-22(29)20(27)19-13(3)18(14(4)26(19)5)21(28)24-15-6-7-17(23)12(2)10-15;2*1-10-8-13(9-23-19(10)22)24-20(29)16-11(2)17(26(4)12(16)3)18(28)21(30)25-14-6-5-7-15(14)27/h7-8,11,17-18,29H,4-6,9-10H2,1-3H3,(H,26,31)(H,27,32);8-9,11-12,16H,6-7,10H2,1-5H3,(H,25,29)(H,26,30);8-10,16-17,27H,5-7H2,1-4H3,(H,24,29)(H,25,30);6-7,10-11,16H,8-9H2,1-5H3,(H,24,28)(H,25,29);2*8-9,14-15,27H,5-7H2,1-4H3,(H,24,29)(H,25,30)/t17-,18-;12-,16-;16-,17-;;2*14-,15-/m010.10/s1
InChIKeyZRXFMOHDBAZXSL-APWJFZMTSA-N
XLogP16.71
TPSA587.90 Ų
H-Bond Donors16
H-Bond Acceptors30
Rotatable Bonds32
Heavy Atoms181
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002508.81
LogP ≤ 516.71
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide?
The IUPAC name of 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide (CID 162203631) is 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide.
What is the SMILES notation for 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide?
The canonical SMILES for 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide is Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3CC(C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CCC[C@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@@H]3CC[C@@H](C)C3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(C)c2C)cnc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)N[C@H]3CCC[C@@H]3O)n(CCF)c2C)ccc1F.
What is the InChIKey of 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide?
The InChIKey is ZRXFMOHDBAZXSL-APWJFZMTSA-N. The full InChI is InChI=1S/C23H27F2N3O4.C23H28FN3O3.C22H26FN3O4.C22H26FN3O3.2C21H25FN4O4/c1-12-11-15(7-8-16(12)25)26-22(31)19-13(2)20(28(10-9-24)14(19)3)21(30)23(32)27-17-5-4-6-18(17)29;1-12-6-7-16(10-12)26-23(30)21(28)20-14(3)19(15(4)27(20)5)22(29)25-17-8-9-18(24)13(2)11-17;1-11-10-14(8-9-15(11)23)24-21(29)18-12(2)19(26(4)13(18)3)20(28)22(30)25-16-6-5-7-17(16)27;1-11-8-16(9-11)25-22(29)20(27)19-13(3)18(14(4)26(19)5)21(28)24-15-6-7-17(23)12(2)10-15;2*1-10-8-13(9-23-19(10)22)24-20(29)16-11(2)17(26(4)12(16)3)18(28)21(30)25-14-6-5-7-15(14)27/h7-8,11,17-18,29H,4-6,9-10H2,1-3H3,(H,26,31)(H,27,32);8-9,11-12,16H,6-7,10H2,1-5H3,(H,25,29)(H,26,30);8-10,16-17,27H,5-7H2,1-4H3,(H,24,29)(H,25,30);6-7,10-11,16H,8-9H2,1-5H3,(H,24,28)(H,25,29);2*8-9,14-15,27H,5-7H2,1-4H3,(H,24,29)(H,25,30)/t17-,18-;12-,16-;16-,17-;;2*14-,15-/m010.10/s1.
What are the key properties of 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide?
1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide has a molecular weight of 2508.81 g/mol, XLogP of 16.71, 32 rotatable bonds, 16 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-2,4-dimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(3-methylcyclobutyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[[(1R,3R)-3-methylcyclopentyl]amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1S,2S)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide;N-(6-fluoro-5-methyl-3-pyridinyl)-5-[2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-2-oxoacetyl]-1,2,4-trimethylpyrrole-3-carboxamide is sourced from PubChem (CID 162203631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).