[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane

C20H38OSi — CID 135020043

IUPAC[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane
SMILESC=C[C@H]1C(=C(C)C)CC[C@]1(C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C20H38OSi/c1-11-19-18(14(2)3)12-13-20(19,10)21-22(15(4)5,16(6)7)17(8)9/h11,15-17,19H,1,12-13H2,2-10H3/t19-,20-/m0/s1
InChIKeyFJILHJRNTCZISQ-PMACEKPBSA-N
MW322.61 g/mol
LogP6.87
Rot. Bonds6

About [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane

[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane (PubChem CID 135020043) has the molecular formula C20H38OSi and a molecular weight of 322.61 g/mol. Its IUPAC name is [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane
PubChem CID135020043
Molecular FormulaC20H38OSi
Molecular Weight322.61 g/mol
Exact Mass322.27
IUPAC Name[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane
SMILESC=C[C@H]1C(=C(C)C)CC[C@]1(C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C20H38OSi/c1-11-19-18(14(2)3)12-13-20(19,10)21-22(15(4)5,16(6)7)17(8)9/h11,15-17,19H,1,12-13H2,2-10H3/t19-,20-/m0/s1
InChIKeyFJILHJRNTCZISQ-PMACEKPBSA-N
XLogP6.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.61
LogP ≤ 56.87
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'}

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Related Compounds

Tert-butyl-dimethyl-(1-methyl-3-methylidene-2-prop-1-en-2-ylcyclopentyl)oxysilane
CID 14911456
[(1S,3aR,8aS)-4-methyl-7-propan-2-yl-1,2,3,3a,6,8a-hexahydroazulen-1-yl]oxy-tert-butyl-dimethylsilane
CID 134957299
Tert-butyl-[[7-(2,2-dimethylpent-4-enyl)-7-bicyclo[2.2.1]hept-2-enyl]oxy]-dimethylsilane
CID 134972664
[(3R,3aR,8aS)-3-ethenyl-5,5-dimethyl-1,2,3,4,6,8a-hexahydroazulen-3a-yl]oxy-tert-butyl-dimethylsilane
CID 134972665
[(1S,2S,3S)-2-ethenyl-1-methyl-3-prop-1-en-2-ylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 135020044
[2-butyl-1-[(E)-3-tributylstannylprop-1-enyl]cyclopentyl]oxy-trimethylsilane
CID 158318058
tert-butyl-[(1S,2R)-2-ethenyl-1-prop-2-enylcyclopentyl]oxy-dimethylsilane
CID 10563730
[(1S,3aS,4Z,8Z,9aS)-4-methyl-2,3,3a,6,7,9a-hexahydro-1H-cyclopenta[8]annulen-1-yl]oxy-tert-butyl-dimethylsilane
CID 10565611
[(1S,2R)-2-ethenyl-1-prop-2-enylcyclopentyl]oxy-trimethylsilane
CID 10775542
(2-Methyl-3-pentylidenecyclopentyl)oxy-tri(propan-2-yl)silane
CID 10791527
tert-butyl-dimethyl-[2-methyl-3-[(E)-oct-1-enyl]cyclopenten-1-yl]oxysilane
CID 11220984
Tert-butyl-dimethyl-(4-methyl-1-propan-2-ylcyclohex-3-en-1-yl)oxysilane
CID 11448578

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane (CID 135020043) is [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane is C=C[C@H]1C(=C(C)C)CC[C@]1(C)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane?
The InChIKey is FJILHJRNTCZISQ-PMACEKPBSA-N. The full InChI is InChI=1S/C20H38OSi/c1-11-19-18(14(2)3)12-13-20(19,10)21-22(15(4)5,16(6)7)17(8)9/h11,15-17,19H,1,12-13H2,2-10H3/t19-,20-/m0/s1.
What are the key properties of [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane?
[(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane has a molecular weight of 322.61 g/mol, XLogP of 6.87, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-2-ethenyl-1-methyl-3-propan-2-ylidenecyclopentyl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 135020043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).