2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane

C25H33FN4OSi — CID 22969450

IUPAC2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1c(-c2cccc(F)c2)cnc1C1CCN(c2ccccn2)CC1
InChIInChI=1S/C25H33FN4OSi/c1-32(2,3)16-15-31-19-30-23(21-7-6-8-22(26)17-21)18-28-25(30)20-10-13-29(14-11-20)24-9-4-5-12-27-24/h4-9,12,17-18,20H,10-11,13-16,19H2,1-3H3
InChIKeyVNZKMGRZGQWQPG-UHFFFAOYSA-N
MW452.65 g/mol
LogP5.78
Rot. Bonds8

About 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane

2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 22969450) has the molecular formula C25H33FN4OSi and a molecular weight of 452.65 g/mol. Its IUPAC name is 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
PubChem CID22969450
Molecular FormulaC25H33FN4OSi
Molecular Weight452.65 g/mol
Exact Mass452.24
IUPAC Name2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1c(-c2cccc(F)c2)cnc1C1CCN(c2ccccn2)CC1
InChIInChI=1S/C25H33FN4OSi/c1-32(2,3)16-15-31-19-30-23(21-7-6-8-22(26)17-21)18-28-25(30)20-10-13-29(14-11-20)24-9-4-5-12-27-24/h4-9,12,17-18,20H,10-11,13-16,19H2,1-3H3
InChIKeyVNZKMGRZGQWQPG-UHFFFAOYSA-N
XLogP5.78
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.65
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane with MolForge

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Related Compounds

4-(4-(4-fluorophenyl)-1-(3-phenylpropyl)-5-(4-pyridinyl)-1H-imidazol-2-yl)-3-butyn-1-ol
CID 3008319
VK-19911
CID 9797240
SB-242235
CID 9863367
SB-216995
CID 5171
Imidazopyridine 18d
CID 5329354
4-[5-(4-Fluoro-phenyl)-3-(3-morpholin-4-yl-propyl)-3H-imidazol-4-yl]-pyrimidin-2-ylamine
CID 9800117
SB-210313
CID 9885504
4-[5-(4-Fluoro-phenyl)-3-(1-methyl-piperidin-4-yl)-3H-imidazol-4-yl]-pyrimidin-2-ylamine
CID 22464113
{4-[7-Dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}-(2-methoxyethyl)amine
CID 24746218
{4-[7-Dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}-(3-methoxypropyl)amine
CID 24746385
2-{[3-(2-Aminopyrimidin-4-yl)-2-(4-fluorophenyl)-imidazo[1,2-a]pyridin-7-ylmethyl]methylamino}ethanol
CID 24887880
4-(2-(4-Fluorophenyl)-7-{[(2-methoxyethyl)methylamino] methyl}imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-ylamine
CID 24887881

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane (CID 22969450) is 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1c(-c2cccc(F)c2)cnc1C1CCN(c2ccccn2)CC1.
What is the InChIKey of 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is VNZKMGRZGQWQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33FN4OSi/c1-32(2,3)16-15-31-19-30-23(21-7-6-8-22(26)17-21)18-28-25(30)20-10-13-29(14-11-20)24-9-4-5-12-27-24/h4-9,12,17-18,20H,10-11,13-16,19H2,1-3H3.
What are the key properties of 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?
2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 452.65 g/mol, XLogP of 5.78, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(3-fluorophenyl)-2-(1-pyridin-2-ylpiperidin-4-yl)imidazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 22969450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).