tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane

C16H25N3OSi — CID 86690744

IUPACtert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane
SMILESCn1nccc1-c1ncccc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H25N3OSi/c1-16(2,3)21(5,6)20-12-13-8-7-10-17-15(13)14-9-11-18-19(14)4/h7-11H,12H2,1-6H3
InChIKeyNHTAJSQFZHOJMK-UHFFFAOYSA-N
MW303.48 g/mol
LogP4.00
Rot. Bonds4

About tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane

tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane (PubChem CID 86690744) has the molecular formula C16H25N3OSi and a molecular weight of 303.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane
PubChem CID86690744
Molecular FormulaC16H25N3OSi
Molecular Weight303.48 g/mol
Exact Mass303.18
IUPAC Nametert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane
SMILESCn1nccc1-c1ncccc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H25N3OSi/c1-16(2,3)21(5,6)20-12-13-8-7-10-17-15(13)14-9-11-18-19(14)4/h7-11H,12H2,1-6H3
InChIKeyNHTAJSQFZHOJMK-UHFFFAOYSA-N
XLogP4.00
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane (CID 86690744) is tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane is Cn1nccc1-c1ncccc1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane?
The InChIKey is NHTAJSQFZHOJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3OSi/c1-16(2,3)21(5,6)20-12-13-8-7-10-17-15(13)14-9-11-18-19(14)4/h7-11H,12H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane?
tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane has a molecular weight of 303.48 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[2-(2-methylpyrazol-3-yl)-3-pyridinyl]methoxy]silane is sourced from PubChem (CID 86690744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).