triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane

C16H26OSi — CID 19428651

IUPACtriethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane
SMILESC#CCC1=C(C)C(O[Si](CC)(CC)CC)CC1=C
InChIInChI=1S/C16H26OSi/c1-7-11-15-13(5)12-16(14(15)6)17-18(8-2,9-3)10-4/h1,16H,5,8-12H2,2-4,6H3
InChIKeyFJXGCHFJEBZSGC-UHFFFAOYSA-N
MW262.47 g/mol
LogP4.68
Rot. Bonds6

About triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane

triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane (PubChem CID 19428651) has the molecular formula C16H26OSi and a molecular weight of 262.47 g/mol. Its IUPAC name is triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane.

Molecular Properties

Compound Nametriethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane
PubChem CID19428651
Molecular FormulaC16H26OSi
Molecular Weight262.47 g/mol
Exact Mass262.18
IUPAC Nametriethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane
SMILESC#CCC1=C(C)C(O[Si](CC)(CC)CC)CC1=C
InChIInChI=1S/C16H26OSi/c1-7-11-15-13(5)12-16(14(15)6)17-18(8-2,9-3)10-4/h1,16H,5,8-12H2,2-4,6H3
InChIKeyFJXGCHFJEBZSGC-UHFFFAOYSA-N
XLogP4.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.47
LogP ≤ 54.68
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'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane?
The IUPAC name of triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane (CID 19428651) is triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane.
What is the SMILES notation for triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane?
The canonical SMILES for triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane is C#CCC1=C(C)C(O[Si](CC)(CC)CC)CC1=C.
What is the InChIKey of triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane?
The InChIKey is FJXGCHFJEBZSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26OSi/c1-7-11-15-13(5)12-16(14(15)6)17-18(8-2,9-3)10-4/h1,16H,5,8-12H2,2-4,6H3.
What are the key properties of triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane?
triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane has a molecular weight of 262.47 g/mol, XLogP of 4.68, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2-methyl-4-methylidene-3-prop-2-ynylcyclopent-2-en-1-yl)oxysilane is sourced from PubChem (CID 19428651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).