5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole

C188H270ClF3N22O2 — CID 161354334

About 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole

5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole (PubChem CID 161354334) has the molecular formula C188H270ClF3N22O2 and a molecular weight of 2962.83 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole.

Molecular Properties

• Compound Name: 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole
• PubChem CID: 161354334
• Molecular Formula: C188H270ClF3N22O2
• Molecular Weight: 2962.83 g/mol
• Exact Mass: 2960.13
• IUPAC Name: 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole
• SMILES: CC(C)c1c(-c2ccccc2)nn(C)c1C(=O)N1CCCCC1.CC1=C(C(C)C)C(c2ccc(Cl)cc2)=NC1.CC1=C(C(C)C)C(c2ccccc2)=NC1.CC1=CCC(C)=C1C(C)C.CC1=NCC(C(F)(F)F)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CCC1=NCC(C)=C1C(C)C.CCC1=NCC(CC)=C1C(C)C.Cc1c(C(C)C)c(-c2ccccc2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C(=O)C1CCN(C)CC1.Cc1c(C(C)C)c(-c2ccccc2)nn1C(C)C.Cc1c(C(C)C)c(-c2ccncc2)nn1C(C)C.Cc1c[nH]c(C)c1C(C)C
• InChI: InChI=1S/C20H27N3O.C19H25N3O.C16H22N2.C15H21N3.C14H16ClN.C14H18N2.C14H17N.C11H19N.C10H17N.C10H16.C9H12F3N.4C9H15N/c1-14(2)18-15(3)23(20(24)17-10-12-22(4)13-11-17)21-19(18)16-8-6-5-7-9-16;1-14(2)16-17(15-10-6-4-7-11-15)20-21(3)18(16)19(23)22-12-8-5-9-13-22;1-11(2)15-13(5)18(12(3)4)17-16(15)14-9-7-6-8-10-14;1-10(2)14-12(5)18(11(3)4)17-15(14)13-6-8-16-9-7-13;1-9(2)13-10(3)8-16-14(13)11-4-6-12(15)7-5-11;1-10(2)13-11(3)16(4)15-14(13)12-8-6-5-7-9-12;1-10(2)13-11(3)9-15-14(13)12-7-5-4-6-8-12;1-5-9-7-12-10(6-2)11(9)8(3)4;1-5-9-10(7(2)3)8(4)6-11-9;1-7(2)10-8(3)5-6-9(10)4;1-5(2)8-6(3)13-4-7(8)9(10,11)12;4*1-6(2)9-7(3)5-10-8(9)4/h5-9,14,17H,10-13H2,1-4H3;4,6-7,10-11,14H,5,8-9,12-13H2,1-3H3;6-12H,1-5H3;6-11H,1-5H3;4-7,9H,8H2,1-3H3;5-10H,1-4H3;4-8,10H,9H2,1-3H3;8H,5-7H2,1-4H3;7H,5-6H2,1-4H3;5,7H,6H2,1-4H3;5H,4H2,1-3H3;3*6H,5H2,1-4H3;5-6,10H,1-4H3
• InChIKey: VOIKAOBBQXYWON-UHFFFAOYSA-N
• XLogP: 49.79
• TPSA: 257.28 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 22
• Rotatable Bonds: 29
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2962.83
LogP ≤ 5	49.79
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole?

The IUPAC name of 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole (CID 161354334) is 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole.

What is the SMILES notation for 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole?

The canonical SMILES for 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole is CC(C)c1c(-c2ccccc2)nn(C)c1C(=O)N1CCCCC1.CC1=C(C(C)C)C(c2ccc(Cl)cc2)=NC1.CC1=C(C(C)C)C(c2ccccc2)=NC1.CC1=CCC(C)=C1C(C)C.CC1=NCC(C(F)(F)F)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CC1=NCC(C)=C1C(C)C.CCC1=NCC(C)=C1C(C)C.CCC1=NCC(CC)=C1C(C)C.Cc1c(C(C)C)c(-c2ccccc2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C(=O)C1CCN(C)CC1.Cc1c(C(C)C)c(-c2ccccc2)nn1C(C)C.Cc1c(C(C)C)c(-c2ccncc2)nn1C(C)C.Cc1c[nH]c(C)c1C(C)C.

What is the InChIKey of 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole?

The InChIKey is VOIKAOBBQXYWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O.C19H25N3O.C16H22N2.C15H21N3.C14H16ClN.C14H18N2.C14H17N.C11H19N.C10H17N.C10H16.C9H12F3N.4C9H15N/c1-14(2)18-15(3)23(20(24)17-10-12-22(4)13-11-17)21-19(18)16-8-6-5-7-9-16;1-14(2)16-17(15-10-6-4-7-11-15)20-21(3)18(16)19(23)22-12-8-5-9-13-22;1-11(2)15-13(5)18(12(3)4)17-16(15)14-9-7-6-8-10-14;1-10(2)14-12(5)18(11(3)4)17-15(14)13-6-8-16-9-7-13;1-9(2)13-10(3)8-16-14(13)11-4-6-12(15)7-5-11;1-10(2)13-11(3)16(4)15-14(13)12-8-6-5-7-9-12;1-10(2)13-11(3)9-15-14(13)12-7-5-4-6-8-12;1-5-9-7-12-10(6-2)11(9)8(3)4;1-5-9-10(7(2)3)8(4)6-11-9;1-7(2)10-8(3)5-6-9(10)4;1-5(2)8-6(3)13-4-7(8)9(10,11)12;4*1-6(2)9-7(3)5-10-8(9)4/h5-9,14,17H,10-13H2,1-4H3;4,6-7,10-11,14H,5,8-9,12-13H2,1-3H3;6-12H,1-5H3;6-11H,1-5H3;4-7,9H,8H2,1-3H3;5-10H,1-4H3;4-8,10H,9H2,1-3H3;8H,5-7H2,1-4H3;7H,5-6H2,1-4H3;5,7H,6H2,1-4H3;5H,4H2,1-3H3;3*6H,5H2,1-4H3;5-6,10H,1-4H3.

What are the key properties of 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole?

5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole has a molecular weight of 2962.83 g/mol, XLogP of 49.79, 29 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;3,5-diethyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;1,3-dimethyl-2-propan-2-ylcyclopenta-1,3-diene;2,4-dimethyl-3-propan-2-yl-1H-pyrrole;tris(3,5-dimethyl-4-propan-2-yl-2H-pyrrole);5-ethyl-3-methyl-4-propan-2-yl-2H-pyrrole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-piperidin-1-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-2H-pyrrole is sourced from PubChem (CID 161354334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).