tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane

C20H32BNO4Si — CID 46737925

IUPACtert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane
SMILESCC1(C)OB(c2cnc3cc(CO[Si](C)(C)C(C)(C)C)oc3c2)OC1(C)C
InChIInChI=1S/C20H32BNO4Si/c1-18(2,3)27(8,9)23-13-15-11-16-17(24-15)10-14(12-22-16)21-25-19(4,5)20(6,7)26-21/h10-12H,13H2,1-9H3
InChIKeyINHBSQTVWYQOCB-UHFFFAOYSA-N
MW389.38 g/mol
LogP4.65
Rot. Bonds4

About tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane

tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane (PubChem CID 46737925) has the molecular formula C20H32BNO4Si and a molecular weight of 389.38 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane
PubChem CID46737925
Molecular FormulaC20H32BNO4Si
Molecular Weight389.38 g/mol
Exact Mass389.22
IUPAC Nametert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane
SMILESCC1(C)OB(c2cnc3cc(CO[Si](C)(C)C(C)(C)C)oc3c2)OC1(C)C
InChIInChI=1S/C20H32BNO4Si/c1-18(2,3)27(8,9)23-13-15-11-16-17(24-15)10-14(12-22-16)21-25-19(4,5)20(6,7)26-21/h10-12H,13H2,1-9H3
InChIKeyINHBSQTVWYQOCB-UHFFFAOYSA-N
XLogP4.65
TPSA53.72 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.38
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane (CID 46737925) is tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane is CC1(C)OB(c2cnc3cc(CO[Si](C)(C)C(C)(C)C)oc3c2)OC1(C)C.
What is the InChIKey of tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane?
The InChIKey is INHBSQTVWYQOCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32BNO4Si/c1-18(2,3)27(8,9)23-13-15-11-16-17(24-15)10-14(12-22-16)21-25-19(4,5)20(6,7)26-21/h10-12H,13H2,1-9H3.
What are the key properties of tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane?
tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane has a molecular weight of 389.38 g/mol, XLogP of 4.65, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridin-2-yl]methoxy]silane is sourced from PubChem (CID 46737925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).