tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane

C23H32FNOSi — CID 66629995

IUPACtert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCCC1(F)CCNCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H32FNOSi/c1-22(2,3)27(20-10-6-4-7-11-20,21-12-8-5-9-13-21)26-19-16-23(24)14-17-25-18-15-23/h4-13,25H,14-19H2,1-3H3
InChIKeyCXYMUSUJSTZEMV-UHFFFAOYSA-N
MW385.60 g/mol
LogP4.04
Rot. Bonds6

About tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane

tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane (PubChem CID 66629995) has the molecular formula C23H32FNOSi and a molecular weight of 385.60 g/mol. Its IUPAC name is tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane
PubChem CID66629995
Molecular FormulaC23H32FNOSi
Molecular Weight385.60 g/mol
Exact Mass385.22
IUPAC Nametert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCCC1(F)CCNCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H32FNOSi/c1-22(2,3)27(20-10-6-4-7-11-20,21-12-8-5-9-13-21)26-19-16-23(24)14-17-25-18-15-23/h4-13,25H,14-19H2,1-3H3
InChIKeyCXYMUSUJSTZEMV-UHFFFAOYSA-N
XLogP4.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.60
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane (CID 66629995) is tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane is CC(C)(C)[Si](OCCC1(F)CCNCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane?
The InChIKey is CXYMUSUJSTZEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32FNOSi/c1-22(2,3)27(20-10-6-4-7-11-20,21-12-8-5-9-13-21)26-19-16-23(24)14-17-25-18-15-23/h4-13,25H,14-19H2,1-3H3.
What are the key properties of tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane?
tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane has a molecular weight of 385.60 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(4-fluoropiperidin-4-yl)ethoxy]-diphenylsilane is sourced from PubChem (CID 66629995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).