2-ethyl-2-propyloxasilinane

C9H20OSi — CID 174644479

IUPAC2-ethyl-2-propyloxasilinane
SMILESCCC[Si]1(CC)CCCCO1
InChIInChI=1S/C9H20OSi/c1-3-8-11(4-2)9-6-5-7-10-11/h3-9H2,1-2H3
InChIKeyCIKIQXQOHYIDLD-UHFFFAOYSA-N
MW172.34 g/mol
LogP3.17
Rot. Bonds3

About 2-ethyl-2-propyloxasilinane

2-ethyl-2-propyloxasilinane (PubChem CID 174644479) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is 2-ethyl-2-propyloxasilinane.

Molecular Properties

Compound Name2-ethyl-2-propyloxasilinane
PubChem CID174644479
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name2-ethyl-2-propyloxasilinane
SMILESCCC[Si]1(CC)CCCCO1
InChIInChI=1S/C9H20OSi/c1-3-8-11(4-2)9-6-5-7-10-11/h3-9H2,1-2H3
InChIKeyCIKIQXQOHYIDLD-UHFFFAOYSA-N
XLogP3.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-ethyl-2-propyloxasilinane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-propyloxasilinane?
The IUPAC name of 2-ethyl-2-propyloxasilinane (CID 174644479) is 2-ethyl-2-propyloxasilinane.
What is the SMILES notation for 2-ethyl-2-propyloxasilinane?
The canonical SMILES for 2-ethyl-2-propyloxasilinane is CCC[Si]1(CC)CCCCO1.
What is the InChIKey of 2-ethyl-2-propyloxasilinane?
The InChIKey is CIKIQXQOHYIDLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-3-8-11(4-2)9-6-5-7-10-11/h3-9H2,1-2H3.
What are the key properties of 2-ethyl-2-propyloxasilinane?
2-ethyl-2-propyloxasilinane has a molecular weight of 172.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-propyloxasilinane is sourced from PubChem (CID 174644479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).