[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane

C13H25N3O2Si — CID 101425570

IUPAC[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1(C2(CCCN=[N+]=[N-])CO2)CCCC1
InChIInChI=1S/C13H25N3O2Si/c1-19(2,3)18-12(7-4-5-8-12)13(11-17-13)9-6-10-15-16-14/h4-11H2,1-3H3
InChIKeyLTZGTDFGPLGWDM-UHFFFAOYSA-N
MW283.45 g/mol
LogP4.01
Rot. Bonds7

About [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane

[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane (PubChem CID 101425570) has the molecular formula C13H25N3O2Si and a molecular weight of 283.45 g/mol. Its IUPAC name is [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane
PubChem CID101425570
Molecular FormulaC13H25N3O2Si
Molecular Weight283.45 g/mol
Exact Mass283.17
IUPAC Name[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1(C2(CCCN=[N+]=[N-])CO2)CCCC1
InChIInChI=1S/C13H25N3O2Si/c1-19(2,3)18-12(7-4-5-8-12)13(11-17-13)9-6-10-15-16-14/h4-11H2,1-3H3
InChIKeyLTZGTDFGPLGWDM-UHFFFAOYSA-N
XLogP4.01
TPSA70.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.45
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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 [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane?
The IUPAC name of [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane (CID 101425570) is [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane.
What is the SMILES notation for [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane?
The canonical SMILES for [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane is C[Si](C)(C)OC1(C2(CCCN=[N+]=[N-])CO2)CCCC1.
What is the InChIKey of [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane?
The InChIKey is LTZGTDFGPLGWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2Si/c1-19(2,3)18-12(7-4-5-8-12)13(11-17-13)9-6-10-15-16-14/h4-11H2,1-3H3.
What are the key properties of [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane?
[1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane has a molecular weight of 283.45 g/mol, XLogP of 4.01, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(3-azidopropyl)oxiran-2-yl]cyclopentyl]oxy-trimethylsilane is sourced from PubChem (CID 101425570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).