1-Diisopropylsilyloxypent-2-en-4-yne

C11H19OSi — CID 6327729

IUPAC—
SMILESC#CC=CCO[Si](C(C)C)C(C)C
InChIInChI=1S/C11H19OSi/c1-6-7-8-9-12-13(10(2)3)11(4)5/h1,7-8,10-11H,9H2,2-5H3
InChIKeyBTSINLPDBRBWCT-UHFFFAOYSA-N
MW195.36 g/mol
LogP3.00
Rot. Bonds5

About 1-Diisopropylsilyloxypent-2-en-4-yne

1-Diisopropylsilyloxypent-2-en-4-yne (PubChem CID 6327729) has the molecular formula C11H19OSi and a molecular weight of 195.36 g/mol.

Molecular Properties

Compound Name1-Diisopropylsilyloxypent-2-en-4-yne
PubChem CID6327729
Molecular FormulaC11H19OSi
Molecular Weight195.36 g/mol
Exact Mass195.12
IUPAC Name—
SMILESC#CC=CCO[Si](C(C)C)C(C)C
InChIInChI=1S/C11H19OSi/c1-6-7-8-9-12-13(10(2)3)11(4)5/h1,7-8,10-11H,9H2,2-5H3
InChIKeyBTSINLPDBRBWCT-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.36
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-Diisopropylsilyloxypent-2-en-4-yne with MolForge

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

Launch Full Analysis

Related Compounds

1-Trimethylsiloxy-2-butene
CID 5366916
trans-Crotyl alcohol, tert-butyldimethylsilyl ether
CID 11217677
Allyloxy(triethyl) silane
CID 575513
But-2-enoxy(trimethyl)silane
CID 554664
tert-butyl(dimethyl)[(2E)-2-penten-4-ynyloxy]silane
CID 10845580
2,2-Diisopropyl-4,7-dihydro-1,3,2-dioxasilepine
CID 12793734
Tri(propan-2-yl)-prop-2-enoxysilane
CID 13999041
1-Triisobutylsilyloxypent-2-en-4-yne
CID 531260
1-Dimethylisopropylsilyloxypent-2-en-4-yne
CID 531286
1-Tripropylsilyloxypent-2-en-4-yne
CID 531304
1-Trihexylsilyloxypent-2-en-4-yne
CID 531315
1-Tributylsilyloxypent-2-en-4-yne
CID 531334

Frequently Asked Questions

What is the IUPAC name of 1-Diisopropylsilyloxypent-2-en-4-yne?
The IUPAC name of 1-Diisopropylsilyloxypent-2-en-4-yne (CID 6327729) is not available.
What is the SMILES notation for 1-Diisopropylsilyloxypent-2-en-4-yne?
The canonical SMILES for 1-Diisopropylsilyloxypent-2-en-4-yne is C#CC=CCO[Si](C(C)C)C(C)C.
What is the InChIKey of 1-Diisopropylsilyloxypent-2-en-4-yne?
The InChIKey is BTSINLPDBRBWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19OSi/c1-6-7-8-9-12-13(10(2)3)11(4)5/h1,7-8,10-11H,9H2,2-5H3.
What are the key properties of 1-Diisopropylsilyloxypent-2-en-4-yne?
1-Diisopropylsilyloxypent-2-en-4-yne has a molecular weight of 195.36 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Diisopropylsilyloxypent-2-en-4-yne is sourced from PubChem (CID 6327729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).