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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide

C118H139F5N16O17 — CID 158490144

About 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide (PubChem CID 158490144) has the molecular formula C118H139F5N16O17 and a molecular weight of 2148.49 g/mol. Its IUPAC name is 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide.

Molecular Properties

• Compound Name: 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide
• PubChem CID: 158490144
• Molecular Formula: C118H139F5N16O17
• Molecular Weight: 2148.49 g/mol
• Exact Mass: 2147.04
• IUPAC Name: 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide
• SMILES: C=C(O)C1CCC(NC(=O)C(=O)c2c(C)c(C(=O)Nc3ccc(F)c(C)c3)c(C)n2C)CC1.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(C)CCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(C)CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(CO)CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)Nc3ccccn3)n(C)c2C)ccc1F
• InChI: InChI=1S/C25H30FN3O4.C24H30FN3O4.C24H30FN3O3.C23H28FN3O3.C22H21FN4O3/c1-13-12-19(10-11-20(13)26)28-24(32)21-14(2)22(29(5)15(21)3)23(31)25(33)27-18-8-6-17(7-9-18)16(4)30;1-14-12-17(8-9-18(14)25)26-22(31)19-15(2)20(28(4)16(19)3)21(30)23(32)27-24(13-29)10-6-5-7-11-24;1-14-13-17(9-10-18(14)25)26-22(30)19-15(2)20(28(5)16(19)3)21(29)23(31)27-24(4)11-7-6-8-12-24;1-13-12-16(8-9-17(13)24)25-21(29)18-14(2)19(27(5)15(18)3)20(28)22(30)26-23(4)10-6-7-11-23;1-12-11-15(8-9-16(12)23)25-21(29)18-13(2)19(27(4)14(18)3)20(28)22(30)26-17-7-5-6-10-24-17/h10-12,17-18,30H,4,6-9H2,1-3,5H3,(H,27,33)(H,28,32);8-9,12,29H,5-7,10-11,13H2,1-4H3,(H,26,31)(H,27,32);9-10,13H,6-8,11-12H2,1-5H3,(H,26,30)(H,27,31);8-9,12H,6-7,10-11H2,1-5H3,(H,25,29)(H,26,30);5-11H,1-4H3,(H,25,29)(H,24,26,30)
• InChIKey: HIPDVEZRXQVZAZ-UHFFFAOYSA-N
• XLogP: 19.50
• TPSA: 454.35 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 23
• Rotatable Bonds: 27
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2148.49
LogP ≤ 5	19.50
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide?

The IUPAC name of 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide (CID 158490144) is 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide.

What is the SMILES notation for 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide?

The canonical SMILES for 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide is C=C(O)C1CCC(NC(=O)C(=O)c2c(C)c(C(=O)Nc3ccc(F)c(C)c3)c(C)n2C)CC1.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(C)CCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(C)CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(CO)CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)Nc3ccccn3)n(C)c2C)ccc1F.

What is the InChIKey of 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide?

The InChIKey is HIPDVEZRXQVZAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30FN3O4.C24H30FN3O4.C24H30FN3O3.C23H28FN3O3.C22H21FN4O3/c1-13-12-19(10-11-20(13)26)28-24(32)21-14(2)22(29(5)15(21)3)23(31)25(33)27-18-8-6-17(7-9-18)16(4)30;1-14-12-17(8-9-18(14)25)26-22(31)19-15(2)20(28(4)16(19)3)21(30)23(32)27-24(13-29)10-6-5-7-11-24;1-14-13-17(9-10-18(14)25)26-22(30)19-15(2)20(28(5)16(19)3)21(29)23(31)27-24(4)11-7-6-8-12-24;1-13-12-16(8-9-17(13)24)25-21(29)18-14(2)19(27(5)15(18)3)20(28)22(30)26-23(4)10-6-7-11-23;1-12-11-15(8-9-16(12)23)25-21(29)18-13(2)19(27(4)14(18)3)20(28)22(30)26-17-7-5-6-10-24-17/h10-12,17-18,30H,4,6-9H2,1-3,5H3,(H,27,33)(H,28,32);8-9,12,29H,5-7,10-11,13H2,1-4H3,(H,26,31)(H,27,32);9-10,13H,6-8,11-12H2,1-5H3,(H,26,30)(H,27,31);8-9,12H,6-7,10-11H2,1-5H3,(H,25,29)(H,26,30);5-11H,1-4H3,(H,25,29)(H,24,26,30).

What are the key properties of 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide has a molecular weight of 2148.49 g/mol, XLogP of 19.50, 27 rotatable bonds, 12 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 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-[(1-methylcyclohexyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(1-methylcyclopentyl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-(pyridin-2-ylamino)acetyl]pyrrole-3-carboxamide is sourced from PubChem (CID 158490144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).