N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide

C123H157F5N20O18 — CID 158653988

About N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide

N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide (PubChem CID 158653988) has the molecular formula C123H157F5N20O18 and a molecular weight of 2298.72 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide.

Molecular Properties

• Compound Name: N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide
• PubChem CID: 158653988
• Molecular Formula: C123H157F5N20O18
• Molecular Weight: 2298.72 g/mol
• Exact Mass: 2297.19
• IUPAC Name: N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide
• SMILES: Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC(C)(C)CN3CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCC(=O)N3CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCCN3CCOCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCN3CCC(C)CC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCN3CCCC(=O)C3)n(C)c2C)ccc1F
• InChI: InChI=1S/C26H35FN4O3.C25H33FN4O3.C24H31FN4O4.2C24H29FN4O4/c1-16-14-19(10-11-20(16)27)28-24(33)21-17(2)22(30(6)18(21)3)23(32)25(34)29-26(4,5)15-31-12-8-7-9-13-31;1-15-8-11-30(12-9-15)13-10-27-25(33)23(31)22-17(3)21(18(4)29(22)5)24(32)28-19-6-7-20(26)16(2)14-19;1-15-14-18(6-7-19(15)25)27-23(31)20-16(2)21(28(4)17(20)3)22(30)24(32)26-8-5-9-29-10-12-33-13-11-29;1-14-12-17(7-8-19(14)25)27-23(32)20-15(2)21(28(4)16(20)3)22(31)24(33)26-9-11-29-10-5-6-18(30)13-29;1-14-12-17(8-9-18(14)25)27-23(32)20-15(2)21(28(4)16(20)3)22(31)24(33)26-13-19(30)29-10-6-5-7-11-29/h10-11,14H,7-9,12-13,15H2,1-6H3,(H,28,33)(H,29,34);6-7,14-15H,8-13H2,1-5H3,(H,27,33)(H,28,32);6-7,14H,5,8-13H2,1-4H3,(H,26,32)(H,27,31);7-8,12H,5-6,9-11,13H2,1-4H3,(H,26,33)(H,27,32);8-9,12H,5-7,10-11,13H2,1-4H3,(H,26,33)(H,27,32)
• InChIKey: IBXBFSZYZZITFZ-UHFFFAOYSA-N
• XLogP: 14.60
• TPSA: 460.57 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 27
• Rotatable Bonds: 35
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2298.72
LogP ≤ 5	14.60
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide?

The IUPAC name of N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide (CID 158653988) is N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide.

What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide?

The canonical SMILES for N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide is Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NC(C)(C)CN3CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCC(=O)N3CCCCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCCN3CCOCC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCN3CCC(C)CC3)n(C)c2C)ccc1F.Cc1cc(NC(=O)c2c(C)c(C(=O)C(=O)NCCN3CCCC(=O)C3)n(C)c2C)ccc1F.

What is the InChIKey of N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide?

The InChIKey is IBXBFSZYZZITFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35FN4O3.C25H33FN4O3.C24H31FN4O4.2C24H29FN4O4/c1-16-14-19(10-11-20(16)27)28-24(33)21-17(2)22(30(6)18(21)3)23(32)25(34)29-26(4,5)15-31-12-8-7-9-13-31;1-15-8-11-30(12-9-15)13-10-27-25(33)23(31)22-17(3)21(18(4)29(22)5)24(32)28-19-6-7-20(26)16(2)14-19;1-15-14-18(6-7-19(15)25)27-23(31)20-16(2)21(28(4)17(20)3)22(30)24(32)26-8-5-9-29-10-12-33-13-11-29;1-14-12-17(7-8-19(14)25)27-23(32)20-15(2)21(28(4)16(20)3)22(31)24(33)26-9-11-29-10-5-6-18(30)13-29;1-14-12-17(8-9-18(14)25)27-23(32)20-15(2)21(28(4)16(20)3)22(31)24(33)26-13-19(30)29-10-6-5-7-11-29/h10-11,14H,7-9,12-13,15H2,1-6H3,(H,28,33)(H,29,34);6-7,14-15H,8-13H2,1-5H3,(H,27,33)(H,28,32);6-7,14H,5,8-13H2,1-4H3,(H,26,32)(H,27,31);7-8,12H,5-6,9-11,13H2,1-4H3,(H,26,33)(H,27,32);8-9,12H,5-7,10-11,13H2,1-4H3,(H,26,33)(H,27,32).

What are the key properties of N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide?

N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide has a molecular weight of 2298.72 g/mol, XLogP of 14.60, 35 rotatable bonds, 10 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[2-(4-methylpiperidin-1-yl)ethylamino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-[(2-methyl-1-piperidin-1-ylpropan-2-yl)amino]-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-(3-morpholin-4-ylpropylamino)-2-oxoacetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetyl]pyrrole-3-carboxamide;N-(4-fluoro-3-methylphenyl)-1,2,4-trimethyl-5-[2-oxo-2-[2-(3-oxopiperidin-1-yl)ethylamino]acetyl]pyrrole-3-carboxamide is sourced from PubChem (CID 158653988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).