triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane

C15H28OSi — CID 67641410

IUPACtriethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane
SMILESC=C1C[C@H](O[Si](CC)(CC)CC)C=C1C(C)C
InChIInChI=1S/C15H28OSi/c1-7-17(8-2,9-3)16-14-10-13(6)15(11-14)12(4)5/h11-12,14H,6-10H2,1-5H3/t14-/m0/s1
InChIKeyXQJJYVUACWCJKV-AWEZNQCLSA-N
MW252.47 g/mol
LogP4.92
Rot. Bonds6

About triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane

triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane (PubChem CID 67641410) has the molecular formula C15H28OSi and a molecular weight of 252.47 g/mol. Its IUPAC name is triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane
PubChem CID67641410
Molecular FormulaC15H28OSi
Molecular Weight252.47 g/mol
Exact Mass252.19
IUPAC Nametriethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane
SMILESC=C1C[C@H](O[Si](CC)(CC)CC)C=C1C(C)C
InChIInChI=1S/C15H28OSi/c1-7-17(8-2,9-3)16-14-10-13(6)15(11-14)12(4)5/h11-12,14H,6-10H2,1-5H3/t14-/m0/s1
InChIKeyXQJJYVUACWCJKV-AWEZNQCLSA-N
XLogP4.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.47
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane?
The IUPAC name of triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane (CID 67641410) is triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane.
What is the SMILES notation for triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane?
The canonical SMILES for triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane is C=C1C[C@H](O[Si](CC)(CC)CC)C=C1C(C)C.
What is the InChIKey of triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane?
The InChIKey is XQJJYVUACWCJKV-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H28OSi/c1-7-17(8-2,9-3)16-14-10-13(6)15(11-14)12(4)5/h11-12,14H,6-10H2,1-5H3/t14-/m0/s1.
What are the key properties of triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane?
triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane has a molecular weight of 252.47 g/mol, XLogP of 4.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(1S)-4-methylidene-3-propan-2-ylcyclopent-2-en-1-yl]oxysilane is sourced from PubChem (CID 67641410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).