trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane

C26H31F6N5OSi — CID 22969521

IUPACtrimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1cc(-c2cccc(C(F)(F)F)c2)nc1N1CCN(c2ncccc2C(F)(F)F)CC1
InChIInChI=1S/C26H31F6N5OSi/c1-39(2,3)15-14-38-18-37-17-22(19-6-4-7-20(16-19)25(27,28)29)34-24(37)36-12-10-35(11-13-36)23-21(26(30,31)32)8-5-9-33-23/h4-9,16-17H,10-15,18H2,1-3H3
InChIKeyRNXBURMXZAKZRA-UHFFFAOYSA-N
MW571.64 g/mol
LogP6.62
Rot. Bonds8

About trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane (PubChem CID 22969521) has the molecular formula C26H31F6N5OSi and a molecular weight of 571.64 g/mol. Its IUPAC name is trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane
PubChem CID22969521
Molecular FormulaC26H31F6N5OSi
Molecular Weight571.64 g/mol
Exact Mass571.22
IUPAC Nametrimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1cc(-c2cccc(C(F)(F)F)c2)nc1N1CCN(c2ncccc2C(F)(F)F)CC1
InChIInChI=1S/C26H31F6N5OSi/c1-39(2,3)15-14-38-18-37-17-22(19-6-4-7-20(16-19)25(27,28)29)34-24(37)36-12-10-35(11-13-36)23-21(26(30,31)32)8-5-9-33-23/h4-9,16-17H,10-15,18H2,1-3H3
InChIKeyRNXBURMXZAKZRA-UHFFFAOYSA-N
XLogP6.62
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500571.64
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

L-790070
CID 9806182
SB-242235
CID 9863367
4-[5-(4-Fluoro-phenyl)-3-(3-morpholin-4-yl-propyl)-3H-imidazol-4-yl]-pyrimidin-2-ylamine
CID 9800117
SB-210313
CID 9885504
7-Methyl-5-morpholino-2-phenylimidazo[1,2-a]pyrimidine
CID 1472740
6-Methyl-3-(morpholinomethyl)-2-phenylimidazo[1,2-a]pyridine
CID 3594650
N-(3-imidazol-1-ylpropyl)-2-pyridin-4-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 4581419
4-[2-[4-(4-Fluorophenyl)-5-pyridin-4-ylimidazol-1-yl]ethyl]morpholine
CID 9819884
N,N-diethyl-3-[4-(4-fluorophenyl)-5-pyridin-4-ylimidazol-1-yl]propan-1-amine
CID 10043599
N-benzyl-3-[4-(4-fluorophenyl)-5-pyridin-4-ylimidazol-1-yl]-N-methylpropan-1-amine
CID 10250393
1-(3-Morpholinopropyl)-4-[3-(trifluoromethyl)phenyl]-5-(4-pyridyl)-1H-imidazole
CID 10525956
4-[3-(3-Ethoxypropyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine
CID 10544044

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane (CID 22969521) is trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane is C[Si](C)(C)CCOCn1cc(-c2cccc(C(F)(F)F)c2)nc1N1CCN(c2ncccc2C(F)(F)F)CC1.
What is the InChIKey of trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane?
The InChIKey is RNXBURMXZAKZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31F6N5OSi/c1-39(2,3)15-14-38-18-37-17-22(19-6-4-7-20(16-19)25(27,28)29)34-24(37)36-12-10-35(11-13-36)23-21(26(30,31)32)8-5-9-33-23/h4-9,16-17H,10-15,18H2,1-3H3.
What are the key properties of trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane?
trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane has a molecular weight of 571.64 g/mol, XLogP of 6.62, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[4-[3-(trifluoromethyl)phenyl]-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]imidazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 22969521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).