4-trimethylsilylpent-3-en-2-ol

C8H18OSi — CID 71414181

IUPAC4-trimethylsilylpent-3-en-2-ol
SMILESCC(=CC(C)O)[Si](C)(C)C
InChIInChI=1S/C8H18OSi/c1-7(9)6-8(2)10(3,4)5/h6-7,9H,1-5H3
InChIKeyPMWRRRACJCTSQI-UHFFFAOYSA-N
MW158.32 g/mol
LogP2.19
Rot. Bonds2

About 4-trimethylsilylpent-3-en-2-ol

4-trimethylsilylpent-3-en-2-ol (PubChem CID 71414181) has the molecular formula C8H18OSi and a molecular weight of 158.32 g/mol. Its IUPAC name is 4-trimethylsilylpent-3-en-2-ol.

Molecular Properties

Compound Name4-trimethylsilylpent-3-en-2-ol
PubChem CID71414181
Molecular FormulaC8H18OSi
Molecular Weight158.32 g/mol
Exact Mass158.11
IUPAC Name4-trimethylsilylpent-3-en-2-ol
SMILESCC(=CC(C)O)[Si](C)(C)C
InChIInChI=1S/C8H18OSi/c1-7(9)6-8(2)10(3,4)5/h6-7,9H,1-5H3
InChIKeyPMWRRRACJCTSQI-UHFFFAOYSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-trimethylsilylpent-3-en-2-ol 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 4-trimethylsilylpent-3-en-2-ol?
The IUPAC name of 4-trimethylsilylpent-3-en-2-ol (CID 71414181) is 4-trimethylsilylpent-3-en-2-ol.
What is the SMILES notation for 4-trimethylsilylpent-3-en-2-ol?
The canonical SMILES for 4-trimethylsilylpent-3-en-2-ol is CC(=CC(C)O)[Si](C)(C)C.
What is the InChIKey of 4-trimethylsilylpent-3-en-2-ol?
The InChIKey is PMWRRRACJCTSQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18OSi/c1-7(9)6-8(2)10(3,4)5/h6-7,9H,1-5H3.
What are the key properties of 4-trimethylsilylpent-3-en-2-ol?
4-trimethylsilylpent-3-en-2-ol has a molecular weight of 158.32 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilylpent-3-en-2-ol is sourced from PubChem (CID 71414181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).