1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone

C148H178F8N12O7 — CID 159675689

About 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone

1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone (PubChem CID 159675689) has the molecular formula C148H178F8N12O7 and a molecular weight of 2389.11 g/mol. Its IUPAC name is 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone.

Molecular Properties

• Compound Name: 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone
• PubChem CID: 159675689
• Molecular Formula: C148H178F8N12O7
• Molecular Weight: 2389.11 g/mol
• Exact Mass: 2387.38
• IUPAC Name: 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone
• SMILES: CCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCc1cc(C(=O)CN(C)CC(C)C)c(CC)n1-c1ccc(F)cc1.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)CN2CCCC2)c(C)n1Cc1ccc(F)cc1.Cc1cc(C(O)CN2CCCC2)c(C)n1-c1ccc(F)cc1.Cc1cc(CCN2CCCC2)c(C)n1-c1ccc(F)cc1
• InChI: InChI=1S/C21H29FN2O.C21H20FNO.C19H23FN2O.C18H23FN2O.C18H23FN2.C18H22FNO.C17H20FNO.C16H18FNO/c1-6-17-12-19(21(25)14-23(5)13-15(3)4)20(7-2)24(17)18-10-8-16(22)9-11-18;1-15-14-20(21(24)13-8-17-6-4-3-5-7-17)16(2)23(15)19-11-9-18(22)10-12-19;1-14-11-18(19(23)13-21-9-3-4-10-21)15(2)22(14)12-16-5-7-17(20)8-6-16;1-13-11-17(18(22)12-20-9-3-4-10-20)14(2)21(13)16-7-5-15(19)6-8-16;1-14-13-16(9-12-20-10-3-4-11-20)15(2)21(14)18-7-5-17(19)6-8-18;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;1-4-5-16(19)15-10-11(2)18(12(15)3)14-8-6-13(17)7-9-14/h8-12,15H,6-7,13-14H2,1-5H3;3-7,9-12,14H,8,13H2,1-2H3;5-8,11H,3-4,9-10,12-13H2,1-2H3;5-8,11,18,22H,3-4,9-10,12H2,1-2H3;5-8,13H,3-4,9-12H2,1-2H3;6-9,11-12H,5,10H2,1-4H3;7-11H,4-6H2,1-3H3;6-10H,4-5H2,1-3H3
• InChIKey: MUOKTQPNMAECCK-UHFFFAOYSA-N
• XLogP: 34.04
• TPSA: 175.05 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 40
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2389.11
LogP ≤ 5	34.04
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The IUPAC name of 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone (CID 159675689) is 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone.

What is the SMILES notation for 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The canonical SMILES for 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone is CCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCCCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C.CCc1cc(C(=O)CN(C)CC(C)C)c(CC)n1-c1ccc(F)cc1.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)CN2CCCC2)c(C)n1Cc1ccc(F)cc1.Cc1cc(C(O)CN2CCCC2)c(C)n1-c1ccc(F)cc1.Cc1cc(CCN2CCCC2)c(C)n1-c1ccc(F)cc1.

What is the InChIKey of 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The InChIKey is MUOKTQPNMAECCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29FN2O.C21H20FNO.C19H23FN2O.C18H23FN2O.C18H23FN2.C18H22FNO.C17H20FNO.C16H18FNO/c1-6-17-12-19(21(25)14-23(5)13-15(3)4)20(7-2)24(17)18-10-8-16(22)9-11-18;1-15-14-20(21(24)13-8-17-6-4-3-5-7-17)16(2)23(15)19-11-9-18(22)10-12-19;1-14-11-18(19(23)13-21-9-3-4-10-21)15(2)22(14)12-16-5-7-17(20)8-6-16;1-13-11-17(18(22)12-20-9-3-4-10-20)14(2)21(13)16-7-5-15(19)6-8-16;1-14-13-16(9-12-20-10-3-4-11-20)15(2)21(14)18-7-5-17(19)6-8-18;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;1-4-5-16(19)15-10-11(2)18(12(15)3)14-8-6-13(17)7-9-14/h8-12,15H,6-7,13-14H2,1-5H3;3-7,9-12,14H,8,13H2,1-2H3;5-8,11H,3-4,9-10,12-13H2,1-2H3;5-8,11,18,22H,3-4,9-10,12H2,1-2H3;5-8,13H,3-4,9-12H2,1-2H3;6-9,11-12H,5,10H2,1-4H3;7-11H,4-6H2,1-3H3;6-10H,4-5H2,1-3H3.

What are the key properties of 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone has a molecular weight of 2389.11 g/mol, XLogP of 34.04, 40 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2,5-diethyl-1-(4-fluorophenyl)pyrrol-3-yl]-2-[methyl(2-methylpropyl)amino]ethanone;1-(4-fluorophenyl)-2,5-dimethyl-3-(2-pyrrolidin-1-ylethyl)pyrrole;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]butan-1-one;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-methylpentan-1-one;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;1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanol;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone is sourced from PubChem (CID 159675689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).