N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone

C133H123F3N6O6 — CID 157379494

About N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone

N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone (PubChem CID 157379494) has the molecular formula C133H123F3N6O6 and a molecular weight of 1958.48 g/mol. Its IUPAC name is N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone.

Molecular Properties

• Compound Name: N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone
• PubChem CID: 157379494
• Molecular Formula: C133H123F3N6O6
• Molecular Weight: 1958.48 g/mol
• Exact Mass: 1956.95
• IUPAC Name: N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone
• SMILES: C#CCc1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.C=C(C)c1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.CC(C)c1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.CC(F)(F)Oc1ccc(NC(=O)n2cc(-c3ccccc3)c3ccccc32)cc1.Cc1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)c(F)c1
• InChI: InChI=1S/C28H29NO.C28H27NO.C28H25NO.C26H24FNO.C23H18F2N2O2/c2*1-19(2)22-15-13-21(14-16-22)17-28(30)29-18-26(25-11-7-8-12-27(25)29)24-10-6-5-9-23(24)20(3)4;1-4-9-21-14-16-22(17-15-21)18-28(30)29-19-26(25-12-7-8-13-27(25)29)24-11-6-5-10-23(24)20(2)3;1-17(2)20-8-4-5-9-21(20)23-16-28(25-11-7-6-10-22(23)25)26(29)15-19-13-12-18(3)14-24(19)27;1-23(24,25)29-18-13-11-17(12-14-18)26-22(28)27-15-20(16-7-3-2-4-8-16)19-9-5-6-10-21(19)27/h5-16,18-20H,17H2,1-4H3;5-16,18,20H,1,17H2,2-4H3;1,5-8,10-17,19-20H,9,18H2,2-3H3;4-14,16-17H,15H2,1-3H3;2-15H,1H3,(H,26,28)
• InChIKey: BKSAHDQZHUAJFW-UHFFFAOYSA-N
• XLogP: 34.42
• TPSA: 131.26 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 11
• Rotatable Bonds: 23
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1958.48
LogP ≤ 5	34.42
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone?

The IUPAC name of N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone (CID 157379494) is N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone.

What is the SMILES notation for N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone?

The canonical SMILES for N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone is C#CCc1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.C=C(C)c1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.CC(C)c1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)cc1.CC(F)(F)Oc1ccc(NC(=O)n2cc(-c3ccccc3)c3ccccc32)cc1.Cc1ccc(CC(=O)n2cc(-c3ccccc3C(C)C)c3ccccc32)c(F)c1.

What is the InChIKey of N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone?

The InChIKey is BKSAHDQZHUAJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29NO.C28H27NO.C28H25NO.C26H24FNO.C23H18F2N2O2/c2*1-19(2)22-15-13-21(14-16-22)17-28(30)29-18-26(25-11-7-8-12-27(25)29)24-10-6-5-9-23(24)20(3)4;1-4-9-21-14-16-22(17-15-21)18-28(30)29-19-26(25-12-7-8-13-27(25)29)24-11-6-5-10-23(24)20(2)3;1-17(2)20-8-4-5-9-21(20)23-16-28(25-11-7-6-10-22(23)25)26(29)15-19-13-12-18(3)14-24(19)27;1-23(24,25)29-18-13-11-17(12-14-18)26-22(28)27-15-20(16-7-3-2-4-8-16)19-9-5-6-10-21(19)27/h5-16,18-20H,17H2,1-4H3;5-16,18,20H,1,17H2,2-4H3;1,5-8,10-17,19-20H,9,18H2,2-3H3;4-14,16-17H,15H2,1-3H3;2-15H,1H3,(H,26,28).

What are the key properties of N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone?

N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone has a molecular weight of 1958.48 g/mol, XLogP of 34.42, 23 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(1,1-difluoroethoxy)phenyl]-3-phenylindole-1-carboxamide;2-(2-fluoro-4-methylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-1-en-2-ylphenyl)ethanone;1-[3-(2-propan-2-ylphenyl)indol-1-yl]-2-(4-prop-2-ynylphenyl)ethanone;2-(4-propan-2-ylphenyl)-1-[3-(2-propan-2-ylphenyl)indol-1-yl]ethanone is sourced from PubChem (CID 157379494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).