tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate

C24H35NO3Si — CID 123833100

IUPACtert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate
SMILESCN(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)OC(C)(C)C
InChIInChI=1S/C24H35NO3Si/c1-23(2,3)28-22(26)25(7)18-19-27-29(24(4,5)6,20-14-10-8-11-15-20)21-16-12-9-13-17-21/h8-17H,18-19H2,1-7H3
InChIKeyFYPGFAJTFXFHSR-UHFFFAOYSA-N
MW413.63 g/mol
LogP4.43
Rot. Bonds6

About tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate

tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate (PubChem CID 123833100) has the molecular formula C24H35NO3Si and a molecular weight of 413.63 g/mol. Its IUPAC name is tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate.

Molecular Properties

Compound Nametert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate
PubChem CID123833100
Molecular FormulaC24H35NO3Si
Molecular Weight413.63 g/mol
Exact Mass413.24
IUPAC Nametert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate
SMILESCN(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)OC(C)(C)C
InChIInChI=1S/C24H35NO3Si/c1-23(2,3)28-22(26)25(7)18-19-27-29(24(4,5)6,20-14-10-8-11-15-20)21-16-12-9-13-17-21/h8-17H,18-19H2,1-7H3
InChIKeyFYPGFAJTFXFHSR-UHFFFAOYSA-N
XLogP4.43
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.63
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate?
The IUPAC name of tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate (CID 123833100) is tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate.
What is the SMILES notation for tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate?
The canonical SMILES for tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate is CN(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate?
The InChIKey is FYPGFAJTFXFHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35NO3Si/c1-23(2,3)28-22(26)25(7)18-19-27-29(24(4,5)6,20-14-10-8-11-15-20)21-16-12-9-13-17-21/h8-17H,18-19H2,1-7H3.
What are the key properties of tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate?
tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate has a molecular weight of 413.63 g/mol, XLogP of 4.43, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methylcarbamate is sourced from PubChem (CID 123833100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).