N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

C54H68N10O5Si2 — CID 164999091

About N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide (PubChem CID 164999091) has the molecular formula C54H68N10O5Si2 and a molecular weight of 993.37 g/mol. Its IUPAC name is N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
• PubChem CID: 164999091
• Molecular Formula: C54H68N10O5Si2
• Molecular Weight: 993.37 g/mol
• Exact Mass: 992.49
• IUPAC Name: N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
• SMILES: CC1(C)CN(C(=O)CCC[Si](C)(C)O)c2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21.CC1(C)CN(CC[Si](C)(C)O)c2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21
• InChI: InChI=1S/C28H35N5O3Si.C26H33N5O2Si/c1-28(2)19-33(25(34)8-6-16-37(3,4)36)24-17-21(9-10-23(24)28)32-27(35)22-7-5-13-30-26(22)31-18-20-11-14-29-15-12-20;1-26(2)18-31(14-15-34(3,4)33)23-16-20(7-8-22(23)26)30-25(32)21-6-5-11-28-24(21)29-17-19-9-12-27-13-10-19/h5,7,9-15,17,36H,6,8,16,18-19H2,1-4H3,(H,30,31)(H,32,35);5-13,16,33H,14-15,17-18H2,1-4H3,(H,28,29)(H,30,32)
• InChIKey: HZBJIIBQJZMTJT-UHFFFAOYSA-N
• XLogP: 9.58
• TPSA: 197.83 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 12
• Rotatable Bonds: 17
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	993.37
LogP ≤ 5	9.58
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide?

The IUPAC name of N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide (CID 164999091) is N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide.

What is the SMILES notation for N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide?

The canonical SMILES for N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide is CC1(C)CN(C(=O)CCC[Si](C)(C)O)c2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21.CC1(C)CN(CC[Si](C)(C)O)c2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21.

What is the InChIKey of N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide?

The InChIKey is HZBJIIBQJZMTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N5O3Si.C26H33N5O2Si/c1-28(2)19-33(25(34)8-6-16-37(3,4)36)24-17-21(9-10-23(24)28)32-27(35)22-7-5-13-30-26(22)31-18-20-11-14-29-15-12-20;1-26(2)18-31(14-15-34(3,4)33)23-16-20(7-8-22(23)26)30-25(32)21-6-5-11-28-24(21)29-17-19-9-12-27-13-10-19/h5,7,9-15,17,36H,6,8,16,18-19H2,1-4H3,(H,30,31)(H,32,35);5-13,16,33H,14-15,17-18H2,1-4H3,(H,28,29)(H,30,32).

What are the key properties of N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide?

N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide has a molecular weight of 993.37 g/mol, XLogP of 9.58, 17 rotatable bonds, 6 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[4-[hydroxy(dimethyl)silyl]butanoyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;N-[1-[2-[hydroxy(dimethyl)silyl]ethyl]-3,3-dimethyl-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 164999091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).