2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane

C69H115BrN12O2Si2 — CID 163577789

About 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane

2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane (PubChem CID 163577789) has the molecular formula C69H115BrN12O2Si2 and a molecular weight of 1280.84 g/mol. Its IUPAC name is 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane.

Molecular Properties

• Compound Name: 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane
• PubChem CID: 163577789
• Molecular Formula: C69H115BrN12O2Si2
• Molecular Weight: 1280.84 g/mol
• Exact Mass: 1278.80
• IUPAC Name: 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane
• SMILES: C.C.C.C1CN(C2CC2)CCN1.CC.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(Br)c3n2COCC[Si](C)(C)C)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(N4CCN(C5CC5)CC4)c3n2COCC[Si](C)(C)C)N1C
• InChI: InChI=1S/C32H48N6OSi.C25H35BrN4OSi.C7H14N2.C2H6.3CH4/c1-24-9-8-16-33-30(24)27-11-7-13-29(35(27)2)32-34-26-10-6-12-28(37-19-17-36(18-20-37)25-14-15-25)31(26)38(32)23-39-21-22-40(3,4)5;1-18-9-8-14-27-23(18)21-12-7-13-22(29(21)2)25-28-20-11-6-10-19(26)24(20)30(25)17-31-15-16-32(3,4)5;1-2-7(1)9-5-3-8-4-6-9;1-2;;;/h6,8-10,12,16,25,27,29H,7,11,13-15,17-23H2,1-5H3;6,8-11,14,21-22H,7,12-13,15-17H2,1-5H3;7-8H,1-6H2;1-2H3;3*1H4/t27-,29+;21-,22+;;;;;/m00...../s1
• InChIKey: GEZKTUHMXLDVKV-MQQNBQEPSA-N
• XLogP: 15.94
• TPSA: 108.11 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 17
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1280.84
LogP ≤ 5	15.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

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 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane?

The IUPAC name of 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane (CID 163577789) is 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane.

What is the SMILES notation for 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane?

The canonical SMILES for 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane is C.C.C.C1CN(C2CC2)CCN1.CC.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(Br)c3n2COCC[Si](C)(C)C)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(N4CCN(C5CC5)CC4)c3n2COCC[Si](C)(C)C)N1C.

What is the InChIKey of 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane?

The InChIKey is GEZKTUHMXLDVKV-MQQNBQEPSA-N. The full InChI is InChI=1S/C32H48N6OSi.C25H35BrN4OSi.C7H14N2.C2H6.3CH4/c1-24-9-8-16-33-30(24)27-11-7-13-29(35(27)2)32-34-26-10-6-12-28(37-19-17-36(18-20-37)25-14-15-25)31(26)38(32)23-39-21-22-40(3,4)5;1-18-9-8-14-27-23(18)21-12-7-13-22(29(21)2)25-28-20-11-6-10-19(26)24(20)30(25)17-31-15-16-32(3,4)5;1-2-7(1)9-5-3-8-4-6-9;1-2;;;/h6,8-10,12,16,25,27,29H,7,11,13-15,17-23H2,1-5H3;6,8-11,14,21-22H,7,12-13,15-17H2,1-5H3;7-8H,1-6H2;1-2H3;3*1H4/t27-,29+;21-,22+;;;;;/m00...../s1.

What are the key properties of 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane?

2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane has a molecular weight of 1280.84 g/mol, XLogP of 15.94, 17 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[7-bromo-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;1-cyclopropylpiperazine;2-[[7-(4-cyclopropylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]benzimidazol-1-yl]methoxy]ethyl-trimethylsilane;ethane;methane is sourced from PubChem (CID 163577789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).