N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide

C129H113F12N19O9S2 — CID 160979342

About N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide

N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide (PubChem CID 160979342) has the molecular formula C129H113F12N19O9S2 and a molecular weight of 2365.56 g/mol. Its IUPAC name is N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide.

Molecular Properties

• Compound Name: N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
• PubChem CID: 160979342
• Molecular Formula: C129H113F12N19O9S2
• Molecular Weight: 2365.56 g/mol
• Exact Mass: 2363.82
• IUPAC Name: N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
• SMILES: C=CS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCCS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCn1c(-c2ccc(C(=O)NCCNC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(NC(C)=O)cc2)c(C#N)c2ccccc21.CCn1c(-c2cccc(NC(=O)C3CC3)c2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2cccc(NC(=O)c3ccccc3)c2)c(C#N)c2ccc(C(F)(F)F)cc21
• InChI: InChI=1S/C25H18F3N3O.C22H18F3N3O.C22H24N4O2.C21H20F3N3O2S.C20H16F3N3O2S.C19H17N3O/c1-2-31-22-14-18(25(26,27)28)11-12-20(22)21(15-29)23(31)17-9-6-10-19(13-17)30-24(32)16-7-4-3-5-8-16;1-2-28-19-11-15(22(23,24)25)8-9-17(19)18(12-26)20(28)14-4-3-5-16(10-14)27-21(29)13-6-7-13;1-4-26-20-13-17(28-3)9-10-18(20)19(14-23)21(26)15-5-7-16(8-6-15)22(27)25-12-11-24-2;1-3-10-30(28,29)26-16-7-5-6-14(11-16)20-18(13-25)17-9-8-15(21(22,23)24)12-19(17)27(20)4-2;1-3-26-18-11-14(20(21,22)23)8-9-16(18)17(12-24)19(26)13-6-5-7-15(10-13)25-29(27,28)4-2;1-3-22-18-7-5-4-6-16(18)17(12-20)19(22)14-8-10-15(11-9-14)21-13(2)23/h3-14H,2H2,1H3,(H,30,32);3-5,8-11,13H,2,6-7H2,1H3,(H,27,29);5-10,13,24H,4,11-12H2,1-3H3,(H,25,27);5-9,11-12,26H,3-4,10H2,1-2H3;4-11,25H,2-3H2,1H3;4-11H,3H2,1-2H3,(H,21,23)
• InChIKey: SZHOXXHHSBSDJJ-UHFFFAOYSA-N
• XLogP: 29.83
• TPSA: 402.32 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 22
• Rotatable Bonds: 29
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2365.56
LogP ≤ 5	29.83
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?

The IUPAC name of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide (CID 160979342) is N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide.

What is the SMILES notation for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?

The canonical SMILES for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide is C=CS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCCS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCn1c(-c2ccc(C(=O)NCCNC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(NC(C)=O)cc2)c(C#N)c2ccccc21.CCn1c(-c2cccc(NC(=O)C3CC3)c2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2cccc(NC(=O)c3ccccc3)c2)c(C#N)c2ccc(C(F)(F)F)cc21.

What is the InChIKey of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?

The InChIKey is SZHOXXHHSBSDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18F3N3O.C22H18F3N3O.C22H24N4O2.C21H20F3N3O2S.C20H16F3N3O2S.C19H17N3O/c1-2-31-22-14-18(25(26,27)28)11-12-20(22)21(15-29)23(31)17-9-6-10-19(13-17)30-24(32)16-7-4-3-5-8-16;1-2-28-19-11-15(22(23,24)25)8-9-17(19)18(12-26)20(28)14-4-3-5-16(10-14)27-21(29)13-6-7-13;1-4-26-20-13-17(28-3)9-10-18(20)19(14-23)21(26)15-5-7-16(8-6-15)22(27)25-12-11-24-2;1-3-10-30(28,29)26-16-7-5-6-14(11-16)20-18(13-25)17-9-8-15(21(22,23)24)12-19(17)27(20)4-2;1-3-26-18-11-14(20(21,22)23)8-9-16(18)17(12-24)19(26)13-6-5-7-15(10-13)25-29(27,28)4-2;1-3-22-18-7-5-4-6-16(18)17(12-20)19(22)14-8-10-15(11-9-14)21-13(2)23/h3-14H,2H2,1H3,(H,30,32);3-5,8-11,13H,2,6-7H2,1H3,(H,27,29);5-10,13,24H,4,11-12H2,1-3H3,(H,25,27);5-9,11-12,26H,3-4,10H2,1-2H3;4-11,25H,2-3H2,1H3;4-11H,3H2,1-2H3,(H,21,23).

What are the key properties of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?

N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide has a molecular weight of 2365.56 g/mol, XLogP of 29.83, 29 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanecarboxamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide is sourced from PubChem (CID 160979342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).