tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane

C15H22FNOSi — CID 53399504

IUPACtert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(F)c2cc[nH]c12
InChIInChI=1S/C15H22FNOSi/c1-15(2,3)19(4,5)18-10-11-6-7-13(16)12-8-9-17-14(11)12/h6-9,17H,10H2,1-5H3
InChIKeyMDVOTFAXLIBUIZ-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.83
Rot. Bonds3

About tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane

tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane (PubChem CID 53399504) has the molecular formula C15H22FNOSi and a molecular weight of 279.43 g/mol. Its IUPAC name is tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane
PubChem CID53399504
Molecular FormulaC15H22FNOSi
Molecular Weight279.43 g/mol
Exact Mass279.15
IUPAC Nametert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(F)c2cc[nH]c12
InChIInChI=1S/C15H22FNOSi/c1-15(2,3)19(4,5)18-10-11-6-7-13(16)12-8-9-17-14(11)12/h6-9,17H,10H2,1-5H3
InChIKeyMDVOTFAXLIBUIZ-UHFFFAOYSA-N
XLogP4.83
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane (CID 53399504) is tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1ccc(F)c2cc[nH]c12.
What is the InChIKey of tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane?
The InChIKey is MDVOTFAXLIBUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNOSi/c1-15(2,3)19(4,5)18-10-11-6-7-13(16)12-8-9-17-14(11)12/h6-9,17H,10H2,1-5H3.
What are the key properties of tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane?
tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane has a molecular weight of 279.43 g/mol, XLogP of 4.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4-fluoro-1H-indol-7-yl)methoxy]-dimethylsilane is sourced from PubChem (CID 53399504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).