2-(1-prop-2-enoxybutyl)oxasilinane

C11H22O2Si — CID 173370568

IUPAC2-(1-prop-2-enoxybutyl)oxasilinane
SMILESC=CCOC(CCC)[SiH]1CCCCO1
InChIInChI=1S/C11H22O2Si/c1-3-7-11(12-8-4-2)14-10-6-5-9-13-14/h4,11,14H,2-3,5-10H2,1H3
InChIKeyXNLKCNYVLPUHMX-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.43
Rot. Bonds6

About 2-(1-prop-2-enoxybutyl)oxasilinane

2-(1-prop-2-enoxybutyl)oxasilinane (PubChem CID 173370568) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 2-(1-prop-2-enoxybutyl)oxasilinane.

Molecular Properties

Compound Name2-(1-prop-2-enoxybutyl)oxasilinane
PubChem CID173370568
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name2-(1-prop-2-enoxybutyl)oxasilinane
SMILESC=CCOC(CCC)[SiH]1CCCCO1
InChIInChI=1S/C11H22O2Si/c1-3-7-11(12-8-4-2)14-10-6-5-9-13-14/h4,11,14H,2-3,5-10H2,1H3
InChIKeyXNLKCNYVLPUHMX-UHFFFAOYSA-N
XLogP2.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(1-prop-2-enoxybutyl)oxasilinane?
The IUPAC name of 2-(1-prop-2-enoxybutyl)oxasilinane (CID 173370568) is 2-(1-prop-2-enoxybutyl)oxasilinane.
What is the SMILES notation for 2-(1-prop-2-enoxybutyl)oxasilinane?
The canonical SMILES for 2-(1-prop-2-enoxybutyl)oxasilinane is C=CCOC(CCC)[SiH]1CCCCO1.
What is the InChIKey of 2-(1-prop-2-enoxybutyl)oxasilinane?
The InChIKey is XNLKCNYVLPUHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-3-7-11(12-8-4-2)14-10-6-5-9-13-14/h4,11,14H,2-3,5-10H2,1H3.
What are the key properties of 2-(1-prop-2-enoxybutyl)oxasilinane?
2-(1-prop-2-enoxybutyl)oxasilinane has a molecular weight of 214.38 g/mol, XLogP of 2.43, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-prop-2-enoxybutyl)oxasilinane is sourced from PubChem (CID 173370568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).