[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane

C17H37N3O2Si2 — CID 102419459

IUPAC[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)O/C=C/[C@H](CCN=[N+]=[N-])O[Si](CC)(CC)CC
InChIInChI=1S/C17H37N3O2Si2/c1-7-23(8-2,9-3)21-16-14-17(13-15-19-20-18)22-24(10-4,11-5)12-6/h14,16-17H,7-13,15H2,1-6H3/b16-14+/t17-/m0/s1
InChIKeyUBGGJDZNLYHUDH-ZQHZRZASSA-N
MW371.67 g/mol
LogP6.61
Rot. Bonds14

About [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane

[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane (PubChem CID 102419459) has the molecular formula C17H37N3O2Si2 and a molecular weight of 371.67 g/mol. Its IUPAC name is [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane.

Molecular Properties

Compound Name[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane
PubChem CID102419459
Molecular FormulaC17H37N3O2Si2
Molecular Weight371.67 g/mol
Exact Mass371.24
IUPAC Name[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)O/C=C/[C@H](CCN=[N+]=[N-])O[Si](CC)(CC)CC
InChIInChI=1S/C17H37N3O2Si2/c1-7-23(8-2,9-3)21-16-14-17(13-15-19-20-18)22-24(10-4,11-5)12-6/h14,16-17H,7-13,15H2,1-6H3/b16-14+/t17-/m0/s1
InChIKeyUBGGJDZNLYHUDH-ZQHZRZASSA-N
XLogP6.61
TPSA67.22 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.67
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane?
The IUPAC name of [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane (CID 102419459) is [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane.
What is the SMILES notation for [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane?
The canonical SMILES for [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane is CC[Si](CC)(CC)O/C=C/[C@H](CCN=[N+]=[N-])O[Si](CC)(CC)CC.
What is the InChIKey of [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane?
The InChIKey is UBGGJDZNLYHUDH-ZQHZRZASSA-N. The full InChI is InChI=1S/C17H37N3O2Si2/c1-7-23(8-2,9-3)21-16-14-17(13-15-19-20-18)22-24(10-4,11-5)12-6/h14,16-17H,7-13,15H2,1-6H3/b16-14+/t17-/m0/s1.
What are the key properties of [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane?
[(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane has a molecular weight of 371.67 g/mol, XLogP of 6.61, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,3S)-5-azido-3-triethylsilyloxypent-1-enoxy]-triethylsilane is sourced from PubChem (CID 102419459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).