1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone

C130H161ClF6N14O6 — CID 159652539

About 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone

1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone (PubChem CID 159652539) has the molecular formula C130H161ClF6N14O6 and a molecular weight of 2165.25 g/mol. Its IUPAC name is 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone.

Molecular Properties

• Compound Name: 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone
• PubChem CID: 159652539
• Molecular Formula: C130H161ClF6N14O6
• Molecular Weight: 2165.25 g/mol
• Exact Mass: 2163.23
• IUPAC Name: 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone
• SMILES: CCc1cc(C(=O)CN(C)CC(C)C)c(CC)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN2CCCC2)c(C)n1-c1ccc(Cl)cc1.Cc1cc(C(=O)CN2CCCC2)c(C)n1CCc1ccc(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.O=C(CN1CCCC1)c1ccn(-c2ccc(F)cc2)c1
• InChI: InChI=1S/C21H29FN2O.C20H25FN2O.C19H23FN2O.C18H21ClN2O.C18H23FN2O.C18H23FN2.C16H17FN2O/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;1-15-13-19(20(24)14-22-10-3-4-11-22)16(2)23(15)12-9-17-5-7-18(21)8-6-17;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;2*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;17-14-3-5-15(6-4-14)19-10-7-13(11-19)16(20)12-18-8-1-2-9-18/h8-12,15H,6-7,13-14H2,1-5H3;5-8,13H,3-4,9-12,14H2,1-2H3;5-8,11H,3-4,9-10,12-13H2,1-2H3;5-8,11H,3-4,9-10,12H2,1-2H3;5-8,11,18,22H,3-4,9-10,12H2,1-2H3;5-8,13H,3-4,9-12H2,1-2H3;3-7,10-11H,1-2,8-9,12H2
• InChIKey: MRTHUNCIXGMHJN-UHFFFAOYSA-N
• XLogP: 26.00
• TPSA: 162.77 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 35
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2165.25
LogP ≤ 5	26.00
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The IUPAC name of 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone (CID 159652539) is 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone.

What is the SMILES notation for 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The canonical SMILES for 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone is CCc1cc(C(=O)CN(C)CC(C)C)c(CC)n1-c1ccc(F)cc1.Cc1cc(C(=O)CN2CCCC2)c(C)n1-c1ccc(Cl)cc1.Cc1cc(C(=O)CN2CCCC2)c(C)n1CCc1ccc(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.O=C(CN1CCCC1)c1ccn(-c2ccc(F)cc2)c1.

What is the InChIKey of 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

The InChIKey is MRTHUNCIXGMHJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29FN2O.C20H25FN2O.C19H23FN2O.C18H21ClN2O.C18H23FN2O.C18H23FN2.C16H17FN2O/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;1-15-13-19(20(24)14-22-10-3-4-11-22)16(2)23(15)12-9-17-5-7-18(21)8-6-17;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;2*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;17-14-3-5-15(6-4-14)19-10-7-13(11-19)16(20)12-18-8-1-2-9-18/h8-12,15H,6-7,13-14H2,1-5H3;5-8,13H,3-4,9-12,14H2,1-2H3;5-8,11H,3-4,9-10,12-13H2,1-2H3;5-8,11H,3-4,9-10,12H2,1-2H3;5-8,11,18,22H,3-4,9-10,12H2,1-2H3;5-8,13H,3-4,9-12H2,1-2H3;3-7,10-11H,1-2,8-9,12H2.

What are the key properties of 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone?

1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone has a molecular weight of 2165.25 g/mol, XLogP of 26.00, 35 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-(4-chlorophenyl)-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]-2-pyrrolidin-1-ylethanol;1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-fluorophenyl)pyrrol-3-yl]-2-pyrrolidin-1-ylethanone is sourced from PubChem (CID 159652539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).