3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate

C16H32O3Si2 — CID 123992182

IUPAC3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate
SMILESC=C(C(=O)OCCC[SiH](C)C)C1([Si](C)(C)C)CCCCO1
InChIInChI=1S/C16H32O3Si2/c1-14(15(17)18-11-9-13-20(2)3)16(21(4,5)6)10-7-8-12-19-16/h20H,1,7-13H2,2-6H3
InChIKeySQQFUXULUANJEJ-UHFFFAOYSA-N
MW328.60 g/mol
LogP3.78
Rot. Bonds7

About 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate

3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate (PubChem CID 123992182) has the molecular formula C16H32O3Si2 and a molecular weight of 328.60 g/mol. Its IUPAC name is 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate.

Molecular Properties

Compound Name3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate
PubChem CID123992182
Molecular FormulaC16H32O3Si2
Molecular Weight328.60 g/mol
Exact Mass328.19
IUPAC Name3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate
SMILESC=C(C(=O)OCCC[SiH](C)C)C1([Si](C)(C)C)CCCCO1
InChIInChI=1S/C16H32O3Si2/c1-14(15(17)18-11-9-13-20(2)3)16(21(4,5)6)10-7-8-12-19-16/h20H,1,7-13H2,2-6H3
InChIKeySQQFUXULUANJEJ-UHFFFAOYSA-N
XLogP3.78
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.60
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate 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 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate?
The IUPAC name of 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate (CID 123992182) is 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate.
What is the SMILES notation for 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate?
The canonical SMILES for 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate is C=C(C(=O)OCCC[SiH](C)C)C1([Si](C)(C)C)CCCCO1.
What is the InChIKey of 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate?
The InChIKey is SQQFUXULUANJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O3Si2/c1-14(15(17)18-11-9-13-20(2)3)16(21(4,5)6)10-7-8-12-19-16/h20H,1,7-13H2,2-6H3.
What are the key properties of 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate?
3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate has a molecular weight of 328.60 g/mol, XLogP of 3.78, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dimethylsilylpropyl 2-(2-trimethylsilyloxan-2-yl)prop-2-enoate is sourced from PubChem (CID 123992182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).