triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane

C17H30OSi — CID 102595887

IUPACtriethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane
SMILESC#CC[C@H]1CCC[C@]1(O[Si](CC)(CC)CC)C(=C)C
InChIInChI=1S/C17H30OSi/c1-7-12-16-13-11-14-17(16,15(5)6)18-19(8-2,9-3)10-4/h1,16H,5,8-14H2,2-4,6H3/t16-,17-/m0/s1
InChIKeyVSJHDLBCJRSSJP-IRXDYDNUSA-N
MW278.51 g/mol
LogP5.15
Rot. Bonds7

About triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane

triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane (PubChem CID 102595887) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane
PubChem CID102595887
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Nametriethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane
SMILESC#CC[C@H]1CCC[C@]1(O[Si](CC)(CC)CC)C(=C)C
InChIInChI=1S/C17H30OSi/c1-7-12-16-13-11-14-17(16,15(5)6)18-19(8-2,9-3)10-4/h1,16H,5,8-14H2,2-4,6H3/t16-,17-/m0/s1
InChIKeyVSJHDLBCJRSSJP-IRXDYDNUSA-N
XLogP5.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.51
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane?
The IUPAC name of triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane (CID 102595887) is triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane.
What is the SMILES notation for triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane?
The canonical SMILES for triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane is C#CC[C@H]1CCC[C@]1(O[Si](CC)(CC)CC)C(=C)C.
What is the InChIKey of triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane?
The InChIKey is VSJHDLBCJRSSJP-IRXDYDNUSA-N. The full InChI is InChI=1S/C17H30OSi/c1-7-12-16-13-11-14-17(16,15(5)6)18-19(8-2,9-3)10-4/h1,16H,5,8-14H2,2-4,6H3/t16-,17-/m0/s1.
What are the key properties of triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane?
triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane has a molecular weight of 278.51 g/mol, XLogP of 5.15, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(1R,2R)-1-prop-1-en-2-yl-2-prop-2-ynylcyclopentyl]oxysilane is sourced from PubChem (CID 102595887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).