trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane

C27H30N6OSi — CID 156686536

About trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane (PubChem CID 156686536) has the molecular formula C27H30N6OSi and a molecular weight of 482.66 g/mol. Its IUPAC name is trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

• Compound Name: trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane
• PubChem CID: 156686536
• Molecular Formula: C27H30N6OSi
• Molecular Weight: 482.66 g/mol
• Exact Mass: 482.23
• IUPAC Name: trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane
• SMILES: Cc1cccc(-c2c(-c3ccc4ncc(-c5cn[nH]c5)cc4c3)ncn2COCC[Si](C)(C)C)n1
• InChI: InChI=1S/C27H30N6OSi/c1-19-6-5-7-25(32-19)27-26(29-17-33(27)18-34-10-11-35(2,3)4)20-8-9-24-21(12-20)13-22(14-28-24)23-15-30-31-16-23/h5-9,12-17H,10-11,18H2,1-4H3,(H,30,31)
• InChIKey: NWZAKFFFDYIOFR-UHFFFAOYSA-N
• XLogP: 6.17
• TPSA: 81.51 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	482.66
LogP ≤ 5	6.17
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane?

The IUPAC name of trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane (CID 156686536) is trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane.

What is the SMILES notation for trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane?

The canonical SMILES for trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane is Cc1cccc(-c2c(-c3ccc4ncc(-c5cn[nH]c5)cc4c3)ncn2COCC[Si](C)(C)C)n1.

What is the InChIKey of trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane?

The InChIKey is NWZAKFFFDYIOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N6OSi/c1-19-6-5-7-25(32-19)27-26(29-17-33(27)18-34-10-11-35(2,3)4)20-8-9-24-21(12-20)13-22(14-28-24)23-15-30-31-16-23/h5-9,12-17H,10-11,18H2,1-4H3,(H,30,31).

What are the key properties of trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane?

trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane has a molecular weight of 482.66 g/mol, XLogP of 6.17, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 156686536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).