4-azidobut-1-ynyl(triethyl)silane

C10H19N3Si — CID 86663839

IUPAC4-azidobut-1-ynyl(triethyl)silane
SMILESCC[Si](C#CCCN=[N+]=[N-])(CC)CC
InChIInChI=1S/C10H19N3Si/c1-4-14(5-2,6-3)10-8-7-9-12-13-11/h4-7,9H2,1-3H3
InChIKeyJNPHYODMJDGDLQ-UHFFFAOYSA-N
MW209.37 g/mol
LogP3.74
Rot. Bonds5

About 4-azidobut-1-ynyl(triethyl)silane

4-azidobut-1-ynyl(triethyl)silane (PubChem CID 86663839) has the molecular formula C10H19N3Si and a molecular weight of 209.37 g/mol. Its IUPAC name is 4-azidobut-1-ynyl(triethyl)silane.

Molecular Properties

Compound Name4-azidobut-1-ynyl(triethyl)silane
PubChem CID86663839
Molecular FormulaC10H19N3Si
Molecular Weight209.37 g/mol
Exact Mass209.13
IUPAC Name4-azidobut-1-ynyl(triethyl)silane
SMILESCC[Si](C#CCCN=[N+]=[N-])(CC)CC
InChIInChI=1S/C10H19N3Si/c1-4-14(5-2,6-3)10-8-7-9-12-13-11/h4-7,9H2,1-3H3
InChIKeyJNPHYODMJDGDLQ-UHFFFAOYSA-N
XLogP3.74
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.37
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 4-azidobut-1-ynyl(triethyl)silane?
The IUPAC name of 4-azidobut-1-ynyl(triethyl)silane (CID 86663839) is 4-azidobut-1-ynyl(triethyl)silane.
What is the SMILES notation for 4-azidobut-1-ynyl(triethyl)silane?
The canonical SMILES for 4-azidobut-1-ynyl(triethyl)silane is CC[Si](C#CCCN=[N+]=[N-])(CC)CC.
What is the InChIKey of 4-azidobut-1-ynyl(triethyl)silane?
The InChIKey is JNPHYODMJDGDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3Si/c1-4-14(5-2,6-3)10-8-7-9-12-13-11/h4-7,9H2,1-3H3.
What are the key properties of 4-azidobut-1-ynyl(triethyl)silane?
4-azidobut-1-ynyl(triethyl)silane has a molecular weight of 209.37 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-azidobut-1-ynyl(triethyl)silane is sourced from PubChem (CID 86663839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).