2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide

C70H81IN14O8Si2 — CID 162248683

About 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide

2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide (PubChem CID 162248683) has the molecular formula C70H81IN14O8Si2 and a molecular weight of 1429.58 g/mol. Its IUPAC name is 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide.

Molecular Properties

• Compound Name: 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide
• PubChem CID: 162248683
• Molecular Formula: C70H81IN14O8Si2
• Molecular Weight: 1429.58 g/mol
• Exact Mass: 1428.49
• IUPAC Name: 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide
• SMILES: CN(C)C(=O)C(O)c1cncc(-c2cnc3[nH]cc(-c4cccnc4)c3c2)c1.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(c2)c(-c2cccnc2)cn3COCC[Si](C)(C)C)c1.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(c2)c(I)cn3COCC[Si](C)(C)C)c1
• InChI: InChI=1S/C27H33N5O3Si.C22H29IN4O3Si.C21H19N5O2/c1-31(2)27(34)25(33)22-11-20(14-29-15-22)21-12-23-24(19-7-6-8-28-13-19)17-32(26(23)30-16-21)18-35-9-10-36(3,4)5;1-26(2)22(29)20(28)17-8-15(10-24-11-17)16-9-18-19(23)13-27(21(18)25-12-16)14-30-6-7-31(3,4)5;1-26(2)21(28)19(27)16-6-14(9-23-10-16)15-7-17-18(12-25-20(17)24-11-15)13-4-3-5-22-8-13/h6-8,11-17,25,33H,9-10,18H2,1-5H3;8-13,20,28H,6-7,14H2,1-5H3;3-12,19,27H,1-2H3,(H,24,25)
• InChIKey: ZXROOWZUPKRZRT-UHFFFAOYSA-N
• XLogP: 11.54
• TPSA: 268.85 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 18
• Rotatable Bonds: 21
• Heavy Atoms: 95
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1429.58
LogP ≤ 5	11.54
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide?

The IUPAC name of 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide (CID 162248683) is 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide.

What is the SMILES notation for 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide?

The canonical SMILES for 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide is CN(C)C(=O)C(O)c1cncc(-c2cnc3[nH]cc(-c4cccnc4)c3c2)c1.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(c2)c(-c2cccnc2)cn3COCC[Si](C)(C)C)c1.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(c2)c(I)cn3COCC[Si](C)(C)C)c1.

What is the InChIKey of 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide?

The InChIKey is ZXROOWZUPKRZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N5O3Si.C22H29IN4O3Si.C21H19N5O2/c1-31(2)27(34)25(33)22-11-20(14-29-15-22)21-12-23-24(19-7-6-8-28-13-19)17-32(26(23)30-16-21)18-35-9-10-36(3,4)5;1-26(2)22(29)20(28)17-8-15(10-24-11-17)16-9-18-19(23)13-27(21(18)25-12-16)14-30-6-7-31(3,4)5;1-26(2)21(28)19(27)16-6-14(9-23-10-16)15-7-17-18(12-25-20(17)24-11-15)13-4-3-5-22-8-13/h6-8,11-17,25,33H,9-10,18H2,1-5H3;8-13,20,28H,6-7,14H2,1-5H3;3-12,19,27H,1-2H3,(H,24,25).

What are the key properties of 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide?

2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide has a molecular weight of 1429.58 g/mol, XLogP of 11.54, 21 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2-hydroxy-N,N-dimethyl-2-[5-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-3-pyridinyl]acetamide;2-hydroxy-N,N-dimethyl-2-[5-[3-pyridin-3-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;2-hydroxy-2-[5-[3-iodo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylacetamide is sourced from PubChem (CID 162248683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).