5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine

C178H164Cl9F18N29O3 — CID 161179070

About 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine

5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine (PubChem CID 161179070) has the molecular formula C178H164Cl9F18N29O3 and a molecular weight of 3418.51 g/mol. Its IUPAC name is 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine
• PubChem CID: 161179070
• Molecular Formula: C178H164Cl9F18N29O3
• Molecular Weight: 3418.51 g/mol
• Exact Mass: 3412.05
• IUPAC Name: 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine
• SMILES: CN1CCN(c2ccc(-c3nc4ccncc4[nH]3)cc2)CC1.CN1CCN(c2ccc(-c3nc4nc(Cl)c(Cl)cc4[nH]3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4c(cc(Cl)cc4C(F)(F)F)C3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4cc(Cl)c(Cl)cc4C3)cc2F)CC1.CN1CCN(c2ccc(C3=Nc4cc(Cl)c(Cl)cc4C3)cn2)CC1.CN1CCN(c2ccc(C3=Nc4ccc(F)cc4C3)cc2)CC1.Cc1cc2c(cc1Cl)CC(c1ccc(OC(F)(F)F)cc1)=N2.Cc1cc2c(cc1F)CC(c1ccc(OC(F)(F)F)cc1)=N2.Cc1ccc2c(c1)CC(c1ccc(N3CCN(C)CC3)cc1)=N2.FC(F)(F)Oc1ccc(C2=Nc3c(cc(Cl)cc3C(F)(F)F)C2)cc1
• InChI: InChI=1S/C20H19ClF3N3.C20H23N3.C19H18Cl2FN3.C19H20FN3.C18H18Cl2N4.C17H17Cl2N5.C17H19N5.C16H8ClF6NO.C16H11ClF3NO.C16H11F4NO/c1-26-6-8-27(9-7-26)16-4-2-13(3-5-16)18-11-14-10-15(21)12-17(19(14)25-18)20(22,23)24;1-15-3-8-19-17(13-15)14-20(21-19)16-4-6-18(7-5-16)23-11-9-22(2)10-12-23;1-24-4-6-25(7-5-24)19-3-2-12(9-16(19)22)17-10-13-8-14(20)15(21)11-18(13)23-17;1-22-8-10-23(11-9-22)17-5-2-14(3-6-17)19-13-15-12-16(20)4-7-18(15)21-19;1-23-4-6-24(7-5-23)18-3-2-12(11-21-18)16-9-13-8-14(19)15(20)10-17(13)22-16;1-23-6-8-24(9-7-23)12-4-2-11(3-5-12)16-20-14-10-13(18)15(19)21-17(14)22-16;1-21-8-10-22(11-9-21)14-4-2-13(3-5-14)17-19-15-6-7-18-12-16(15)20-17;17-10-5-9-6-13(24-14(9)12(7-10)15(18,19)20)8-1-3-11(4-2-8)25-16(21,22)23;2*1-9-6-14-11(7-13(9)17)8-15(21-14)10-2-4-12(5-3-10)22-16(18,19)20/h2-5,10,12H,6-9,11H2,1H3;3-8,13H,9-12,14H2,1-2H3;2-3,8-9,11H,4-7,10H2,1H3;2-7,12H,8-11,13H2,1H3;2-3,8,10-11H,4-7,9H2,1H3;2-5,10H,6-9H2,1H3,(H,20,21,22);2-7,12H,8-11H2,1H3,(H,19,20);1-5,7H,6H2;2*2-7H,8H2,1H3
• InChIKey: USEWQCOUYYFXJH-UHFFFAOYSA-N
• XLogP: 41.77
• TPSA: 267.96 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 30
• Rotatable Bonds: 20
• Heavy Atoms: 237
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3418.51
LogP ≤ 5	41.77
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_G(9)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?

The IUPAC name of 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine (CID 161179070) is 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?

The canonical SMILES for 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine is CN1CCN(c2ccc(-c3nc4ccncc4[nH]3)cc2)CC1.CN1CCN(c2ccc(-c3nc4nc(Cl)c(Cl)cc4[nH]3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4c(cc(Cl)cc4C(F)(F)F)C3)cc2)CC1.CN1CCN(c2ccc(C3=Nc4cc(Cl)c(Cl)cc4C3)cc2F)CC1.CN1CCN(c2ccc(C3=Nc4cc(Cl)c(Cl)cc4C3)cn2)CC1.CN1CCN(c2ccc(C3=Nc4ccc(F)cc4C3)cc2)CC1.Cc1cc2c(cc1Cl)CC(c1ccc(OC(F)(F)F)cc1)=N2.Cc1cc2c(cc1F)CC(c1ccc(OC(F)(F)F)cc1)=N2.Cc1ccc2c(c1)CC(c1ccc(N3CCN(C)CC3)cc1)=N2.FC(F)(F)Oc1ccc(C2=Nc3c(cc(Cl)cc3C(F)(F)F)C2)cc1.

What is the InChIKey of 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?

The InChIKey is USEWQCOUYYFXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClF3N3.C20H23N3.C19H18Cl2FN3.C19H20FN3.C18H18Cl2N4.C17H17Cl2N5.C17H19N5.C16H8ClF6NO.C16H11ClF3NO.C16H11F4NO/c1-26-6-8-27(9-7-26)16-4-2-13(3-5-16)18-11-14-10-15(21)12-17(19(14)25-18)20(22,23)24;1-15-3-8-19-17(13-15)14-20(21-19)16-4-6-18(7-5-16)23-11-9-22(2)10-12-23;1-24-4-6-25(7-5-24)19-3-2-12(9-16(19)22)17-10-13-8-14(20)15(21)11-18(13)23-17;1-22-8-10-23(11-9-22)17-5-2-14(3-6-17)19-13-15-12-16(20)4-7-18(15)21-19;1-23-4-6-24(7-5-23)18-3-2-12(11-21-18)16-9-13-8-14(19)15(20)10-17(13)22-16;1-23-6-8-24(9-7-23)12-4-2-11(3-5-12)16-20-14-10-13(18)15(19)21-17(14)22-16;1-21-8-10-22(11-9-21)14-4-2-13(3-5-14)17-19-15-6-7-18-12-16(15)20-17;17-10-5-9-6-13(24-14(9)12(7-10)15(18,19)20)8-1-3-11(4-2-8)25-16(21,22)23;2*1-9-6-14-11(7-13(9)17)8-15(21-14)10-2-4-12(5-3-10)22-16(18,19)20/h2-5,10,12H,6-9,11H2,1H3;3-8,13H,9-12,14H2,1-2H3;2-3,8-9,11H,4-7,10H2,1H3;2-7,12H,8-11,13H2,1H3;2-3,8,10-11H,4-7,9H2,1H3;2-5,10H,6-9H2,1H3,(H,20,21,22);2-7,12H,8-11H2,1H3,(H,19,20);1-5,7H,6H2;2*2-7H,8H2,1H3.

What are the key properties of 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine?

5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine has a molecular weight of 3418.51 g/mol, XLogP of 41.77, 20 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-7-(trifluoromethyl)-3H-indole;5-chloro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-chloro-2-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-3H-indole;5,6-dichloro-2-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5,6-dichloro-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridine;5,6-dichloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3H-indole;5-fluoro-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;5-fluoro-6-methyl-2-[4-(trifluoromethoxy)phenyl]-3H-indole;5-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-indole;2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 161179070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).