N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide

C98H82F3N23O4 — CID 158369657

About N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide

N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide (PubChem CID 158369657) has the molecular formula C98H82F3N23O4 and a molecular weight of 1702.88 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide.

Molecular Properties

• Compound Name: N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
• PubChem CID: 158369657
• Molecular Formula: C98H82F3N23O4
• Molecular Weight: 1702.88 g/mol
• Exact Mass: 1701.69
• IUPAC Name: N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
• SMILES: CN1CCCC1CCNC(=O)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCCc1ccccn1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCc1ccc(C(F)(F)F)cc1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2[nH]ccc2c1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1
• InChI: InChI=1S/C25H18F3N5O.C25H18N6O.C24H26N6O.C24H20N6O/c26-25(27,28)20-7-1-15(2-8-20)10-31-24(34)17-5-3-16(4-6-17)18-9-21-22(19-12-32-33-13-19)14-30-23(21)29-11-18;32-25(31-20-5-6-23-17(9-20)7-8-26-23)16-3-1-15(2-4-16)18-10-21-22(19-12-29-30-13-19)14-28-24(21)27-11-18;1-30-10-2-3-20(30)8-9-25-24(31)17-6-4-16(5-7-17)18-11-21-22(19-13-28-29-14-19)15-27-23(21)26-12-18;31-24(26-10-8-20-3-1-2-9-25-20)17-6-4-16(5-7-17)18-11-21-22(19-13-29-30-14-19)15-28-23(21)27-12-18/h1-9,11-14H,10H2,(H,29,30)(H,31,34)(H,32,33);1-14,26H,(H,27,28)(H,29,30)(H,31,32);4-7,11-15,20H,2-3,8-10H2,1H3,(H,25,31)(H,26,27)(H,28,29);1-7,9,11-15H,8,10H2,(H,26,31)(H,27,28)(H,29,30)
• InChIKey: GULLTOAZQAYXGU-UHFFFAOYSA-N
• XLogP: 18.74
• TPSA: 377.76 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 14
• Rotatable Bonds: 21
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1702.88
LogP ≤ 5	18.74
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide?

The IUPAC name of N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide (CID 158369657) is N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide.

What is the SMILES notation for N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide?

The canonical SMILES for N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide is CN1CCCC1CCNC(=O)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCCc1ccccn1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCc1ccc(C(F)(F)F)cc1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2[nH]ccc2c1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.

What is the InChIKey of N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide?

The InChIKey is GULLTOAZQAYXGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18F3N5O.C25H18N6O.C24H26N6O.C24H20N6O/c26-25(27,28)20-7-1-15(2-8-20)10-31-24(34)17-5-3-16(4-6-17)18-9-21-22(19-12-32-33-13-19)14-30-23(21)29-11-18;32-25(31-20-5-6-23-17(9-20)7-8-26-23)16-3-1-15(2-4-16)18-10-21-22(19-12-29-30-13-19)14-28-24(21)27-11-18;1-30-10-2-3-20(30)8-9-25-24(31)17-6-4-16(5-7-17)18-11-21-22(19-13-28-29-14-19)15-27-23(21)26-12-18;31-24(26-10-8-20-3-1-2-9-25-20)17-6-4-16(5-7-17)18-11-21-22(19-13-29-30-14-19)15-28-23(21)27-12-18/h1-9,11-14H,10H2,(H,29,30)(H,31,34)(H,32,33);1-14,26H,(H,27,28)(H,29,30)(H,31,32);4-7,11-15,20H,2-3,8-10H2,1H3,(H,25,31)(H,26,27)(H,28,29);1-7,9,11-15H,8,10H2,(H,26,31)(H,27,28)(H,29,30).

What are the key properties of N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide?

N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide has a molecular weight of 1702.88 g/mol, XLogP of 18.74, 21 rotatable bonds, 13 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 158369657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).