trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane

C11H19F3N2OSi — CID 156901506

IUPACtrimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane
SMILESCc1nn(COCC[Si](C)(C)C)cc1C(F)(F)F
InChIInChI=1S/C11H19F3N2OSi/c1-9-10(11(12,13)14)7-16(15-9)8-17-5-6-18(2,3)4/h7H,5-6,8H2,1-4H3
InChIKeyOEWFJNPIRWYBKE-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.52
Rot. Bonds5

About trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane (PubChem CID 156901506) has the molecular formula C11H19F3N2OSi and a molecular weight of 280.37 g/mol. Its IUPAC name is trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane
PubChem CID156901506
Molecular FormulaC11H19F3N2OSi
Molecular Weight280.37 g/mol
Exact Mass280.12
IUPAC Nametrimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane
SMILESCc1nn(COCC[Si](C)(C)C)cc1C(F)(F)F
InChIInChI=1S/C11H19F3N2OSi/c1-9-10(11(12,13)14)7-16(15-9)8-17-5-6-18(2,3)4/h7H,5-6,8H2,1-4H3
InChIKeyOEWFJNPIRWYBKE-UHFFFAOYSA-N
XLogP3.52
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

1-(4-fluoro-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-pyrazol-5-yl)methanamine
CID 165891377
3-Difluoromethyl-1,4-dimethylpyrazole
CID 22980781
1-(Methoxymethyl)-4-methyl-3-(trifluoromethyl)pyrazole
CID 59146360
4-(Difluoromethyl)-1,3-dimethylpyrazole
CID 69534906
1,3-Dimethyl-4-(trifluoromethyl)pyrazole
CID 89546517
1-(2-Methoxyethyl)-4-methyl-3-(trifluoromethyl)pyrazole
CID 89969662
1-(Ethoxymethyl)-3-(trifluoromethyl)pyrazole
CID 91463534
1-(Difluoromethyl)-3,4-dimethylpyrazole
CID 123524025
2,2,2-Trifluoro-1-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]ethanamine
CID 140287013
N-[2,2,2-trifluoro-1-[1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]ethylidene]hydroxylamine
CID 140287080
2-[[4-Bromo-3-(difluoromethyl)pyrazol-1-yl]methoxy]ethyl-trimethylsilane
CID 140721390
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrazole
CID 140874624

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane (CID 156901506) is trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane is Cc1nn(COCC[Si](C)(C)C)cc1C(F)(F)F.
What is the InChIKey of trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane?
The InChIKey is OEWFJNPIRWYBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2OSi/c1-9-10(11(12,13)14)7-16(15-9)8-17-5-6-18(2,3)4/h7H,5-6,8H2,1-4H3.
What are the key properties of trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane?
trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane has a molecular weight of 280.37 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[3-methyl-4-(trifluoromethyl)pyrazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 156901506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).