but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane

C20H34O3Si — CID 101437099

IUPACbut-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane
SMILESC=CCCO[Si](C#CCOC)(OC(C)(C)CCC=C)C1CCCC1
InChIInChI=1S/C20H34O3Si/c1-6-8-15-20(3,4)23-24(18-12-16-21-5,22-17-9-7-2)19-13-10-11-14-19/h6-7,19H,1-2,8-11,13-17H2,3-5H3
InChIKeyFAADANQHWKHEGH-UHFFFAOYSA-N
MW350.58 g/mol
LogP4.92
Rot. Bonds11

About but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane

but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane (PubChem CID 101437099) has the molecular formula C20H34O3Si and a molecular weight of 350.58 g/mol. Its IUPAC name is but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane.

Molecular Properties

Compound Namebut-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane
PubChem CID101437099
Molecular FormulaC20H34O3Si
Molecular Weight350.58 g/mol
Exact Mass350.23
IUPAC Namebut-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane
SMILESC=CCCO[Si](C#CCOC)(OC(C)(C)CCC=C)C1CCCC1
InChIInChI=1S/C20H34O3Si/c1-6-8-15-20(3,4)23-24(18-12-16-21-5,22-17-9-7-2)19-13-10-11-14-19/h6-7,19H,1-2,8-11,13-17H2,3-5H3
InChIKeyFAADANQHWKHEGH-UHFFFAOYSA-N
XLogP4.92
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.58
LogP ≤ 54.92
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane?
The IUPAC name of but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane (CID 101437099) is but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane.
What is the SMILES notation for but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane?
The canonical SMILES for but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane is C=CCCO[Si](C#CCOC)(OC(C)(C)CCC=C)C1CCCC1.
What is the InChIKey of but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane?
The InChIKey is FAADANQHWKHEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34O3Si/c1-6-8-15-20(3,4)23-24(18-12-16-21-5,22-17-9-7-2)19-13-10-11-14-19/h6-7,19H,1-2,8-11,13-17H2,3-5H3.
What are the key properties of but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane?
but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane has a molecular weight of 350.58 g/mol, XLogP of 4.92, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy-cyclopentyl-(3-methoxyprop-1-ynyl)-(2-methylhex-5-en-2-yloxy)silane is sourced from PubChem (CID 101437099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).