2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one

C125H147F7N10O7 — CID 158040615

About 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one

2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one (PubChem CID 158040615) has the molecular formula C125H147F7N10O7 and a molecular weight of 2034.60 g/mol. Its IUPAC name is 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one.

Molecular Properties

• Compound Name: 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one
• PubChem CID: 158040615
• Molecular Formula: C125H147F7N10O7
• Molecular Weight: 2034.60 g/mol
• Exact Mass: 2033.13
• IUPAC Name: 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one
• SMILES: CCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.Cc1cc(C(=O)CCC(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CCc2ccccc2)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)C(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)CC(C)C)c(C)n1-c1ccc(F)cc1
• InChI: InChI=1S/C21H20FNO.C19H25FN2O.C18H23FN2O.C18H22FNO.C17H20FNO.C16H19FN2O.C16H18FNO/c1-15-14-20(21(24)13-8-17-6-4-3-5-7-17)16(2)23(15)19-11-9-18(22)10-12-19;1-13(2)11-21(5)12-19(23)18-10-14(3)22(15(18)4)17-8-6-16(20)7-9-17;1-12(2)20(5)11-18(22)17-10-13(3)21(14(17)4)16-8-6-15(19)7-9-16;1-12(2)5-10-18(21)17-11-13(3)20(14(17)4)16-8-6-15(19)7-9-16;1-4-5-6-17(20)16-11-12(2)19(13(16)3)15-9-7-14(18)8-10-15;1-11-9-15(16(20)10-18(3)4)12(2)19(11)14-7-5-13(17)6-8-14;1-4-5-16(19)15-10-11(2)18(12(15)3)14-8-6-13(17)7-9-14/h3-7,9-12,14H,8,13H2,1-2H3;6-10,13H,11-12H2,1-5H3;6-10,12H,11H2,1-5H3;6-9,11-12H,5,10H2,1-4H3;7-11H,4-6H2,1-3H3;5-9H,10H2,1-4H3;6-10H,4-5H2,1-3H3
• InChIKey: FIHQQGXESZHOSV-UHFFFAOYSA-N
• XLogP: 29.46
• TPSA: 163.72 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 34
• Heavy Atoms: 149
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2034.60
LogP ≤ 5	29.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'pyrrole_A(118)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one?

The IUPAC name of 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one (CID 158040615) is 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one.

What is the SMILES notation for 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one?

The canonical SMILES for 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one is CCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.Cc1cc(C(=O)CCC(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CCc2ccccc2)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)C(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)C)c(C)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN(C)CC(C)C)c(C)n1-c1ccc(F)cc1.

What is the InChIKey of 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one?

The InChIKey is FIHQQGXESZHOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FNO.C19H25FN2O.C18H23FN2O.C18H22FNO.C17H20FNO.C16H19FN2O.C16H18FNO/c1-15-14-20(21(24)13-8-17-6-4-3-5-7-17)16(2)23(15)19-11-9-18(22)10-12-19;1-13(2)11-21(5)12-19(23)18-10-14(3)22(15(18)4)17-8-6-16(20)7-9-17;1-12(2)20(5)11-18(22)17-10-13(3)21(14(17)4)16-8-6-15(19)7-9-16;1-12(2)5-10-18(21)17-11-13(3)20(14(17)4)16-8-6-15(19)7-9-16;1-4-5-6-17(20)16-11-12(2)19(13(16)3)15-9-7-14(18)8-10-15;1-11-9-15(16(20)10-18(3)4)12(2)19(11)14-7-5-13(17)6-8-14;1-4-5-16(19)15-10-11(2)18(12(15)3)14-8-6-13(17)7-9-14/h3-7,9-12,14H,8,13H2,1-2H3;6-10,13H,11-12H2,1-5H3;6-10,12H,11H2,1-5H3;6-9,11-12H,5,10H2,1-4H3;7-11H,4-6H2,1-3H3;5-9H,10H2,1-4H3;6-10H,4-5H2,1-3H3.

What are the key properties of 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one?

2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one has a molecular weight of 2034.60 g/mol, XLogP of 29.46, 34 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(dimethylamino)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[methyl(propan-2-yl)amino]ethanone;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]pentan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-3-phenylpropan-1-one is sourced from PubChem (CID 158040615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).