tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane

C110H141F4IN14O15Si2 — CID 159209225

About tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane

tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane (PubChem CID 159209225) has the molecular formula C110H141F4IN14O15Si2 and a molecular weight of 2158.49 g/mol. Its IUPAC name is tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane.

Molecular Properties

• Compound Name: tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane
• PubChem CID: 159209225
• Molecular Formula: C110H141F4IN14O15Si2
• Molecular Weight: 2158.49 g/mol
• Exact Mass: 2156.92
• IUPAC Name: tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane
• SMILES: CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C(O)c3cn([Si](C(C)C)(C(C)C)C(C)C)c4ncc(C)cc34)c(F)n2)cc1.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C=O)c(F)n2)cc1.COc1ccc(CNc2ccc(C=O)c(F)n2)cc1.Cc1cnc2[nH]cc(Cc3ccc(N)nc3F)c2c1.Cc1cnc2c(c1)c(I)cn2[Si](C(C)C)(C(C)C)C(C)C
• InChI: InChI=1S/C36H49FN4O4Si.C19H21FN2O4.C17H27IN2Si.C14H13FN4.C14H13FN2O2.C10H18O5/c1-22(2)46(23(3)4,24(5)6)41-21-30(29-18-25(7)19-38-34(29)41)32(42)28-16-17-31(39-33(28)37)40(35(43)45-36(8,9)10)20-26-12-14-27(44-11)15-13-26;1-19(2,3)26-18(24)22(11-13-5-8-15(25-4)9-6-13)16-10-7-14(12-23)17(20)21-16;1-11(2)21(12(3)4,13(5)6)20-10-16(18)15-8-14(7)9-19-17(15)20;1-8-4-11-10(7-18-14(11)17-6-8)5-9-2-3-12(16)19-13(9)15;1-19-12-5-2-10(3-6-12)8-16-13-7-4-11(9-18)14(15)17-13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6/h12-19,21-24,32,42H,20H2,1-11H3;5-10,12H,11H2,1-4H3;8-13H,1-7H3;2-4,6-7H,5H2,1H3,(H2,16,19)(H,17,18);2-7,9H,8H2,1H3,(H,16,17);1-6H3
• InChIKey: KQGWQJPMFFJJEF-UHFFFAOYSA-N
• XLogP: 27.00
• TPSA: 356.90 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 26
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2158.49
LogP ≤ 5	27.00
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane?

The IUPAC name of tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane (CID 159209225) is tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane.

What is the SMILES notation for tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane?

The canonical SMILES for tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane is CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C(O)c3cn([Si](C(C)C)(C(C)C)C(C)C)c4ncc(C)cc34)c(F)n2)cc1.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C=O)c(F)n2)cc1.COc1ccc(CNc2ccc(C=O)c(F)n2)cc1.Cc1cnc2[nH]cc(Cc3ccc(N)nc3F)c2c1.Cc1cnc2c(c1)c(I)cn2[Si](C(C)C)(C(C)C)C(C)C.

What is the InChIKey of tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane?

The InChIKey is KQGWQJPMFFJJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H49FN4O4Si.C19H21FN2O4.C17H27IN2Si.C14H13FN4.C14H13FN2O2.C10H18O5/c1-22(2)46(23(3)4,24(5)6)41-21-30(29-18-25(7)19-38-34(29)41)32(42)28-16-17-31(39-33(28)37)40(35(43)45-36(8,9)10)20-26-12-14-27(44-11)15-13-26;1-19(2,3)26-18(24)22(11-13-5-8-15(25-4)9-6-13)16-10-7-14(12-23)17(20)21-16;1-11(2)21(12(3)4,13(5)6)20-10-16(18)15-8-14(7)9-19-17(15)20;1-8-4-11-10(7-18-14(11)17-6-8)5-9-2-3-12(16)19-13(9)15;1-19-12-5-2-10(3-6-12)8-16-13-7-4-11(9-18)14(15)17-13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6/h12-19,21-24,32,42H,20H2,1-11H3;5-10,12H,11H2,1-4H3;8-13H,1-7H3;2-4,6-7H,5H2,1H3,(H2,16,19)(H,17,18);2-7,9H,8H2,1H3,(H,16,17);1-6H3.

What are the key properties of tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane?

tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane has a molecular weight of 2158.49 g/mol, XLogP of 27.00, 26 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl N-[6-fluoro-5-[hydroxy-[5-methyl-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;2-fluoro-6-[(4-methoxyphenyl)methylamino]pyridine-3-carbaldehyde;6-fluoro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]pyridin-2-amine;(3-iodo-5-methylpyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane is sourced from PubChem (CID 159209225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).