2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane

C11H22N2O2Si — CID 141382450

IUPAC2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCCOc1ccnn1COCC[Si](C)(C)C
InChIInChI=1S/C11H22N2O2Si/c1-5-15-11-6-7-12-13(11)10-14-8-9-16(2,3)4/h6-7H,5,8-10H2,1-4H3
InChIKeyKOLPWQMVZRFOJF-UHFFFAOYSA-N
MW242.39 g/mol
LogP2.59
Rot. Bonds7

About 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane

2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane (PubChem CID 141382450) has the molecular formula C11H22N2O2Si and a molecular weight of 242.39 g/mol. Its IUPAC name is 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane
PubChem CID141382450
Molecular FormulaC11H22N2O2Si
Molecular Weight242.39 g/mol
Exact Mass242.15
IUPAC Name2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCCOc1ccnn1COCC[Si](C)(C)C
InChIInChI=1S/C11H22N2O2Si/c1-5-15-11-6-7-12-13(11)10-14-8-9-16(2,3)4/h6-7H,5,8-10H2,1-4H3
InChIKeyKOLPWQMVZRFOJF-UHFFFAOYSA-N
XLogP2.59
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane (CID 141382450) is 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane is CCOc1ccnn1COCC[Si](C)(C)C.
What is the InChIKey of 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is KOLPWQMVZRFOJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2Si/c1-5-15-11-6-7-12-13(11)10-14-8-9-16(2,3)4/h6-7H,5,8-10H2,1-4H3.
What are the key properties of 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane?
2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 242.39 g/mol, XLogP of 2.59, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethoxypyrazol-1-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 141382450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).