[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane

C21H40OSi — CID 135020086

IUPAC[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane
SMILESC=CC[C@@]1(C)CC[C@H](C(=C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H40OSi/c1-11-13-21(10)14-12-19(15(2)3)20(21)22-23(16(4)5,17(6)7)18(8)9/h11,16-20H,1-2,12-14H2,3-10H3/t19-,20-,21+/m1/s1
InChIKeyVTVWFACJWFMEHC-NJYVYQBISA-N
MW336.64 g/mol
LogP7.12
Rot. Bonds8

About [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane

[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane (PubChem CID 135020086) has the molecular formula C21H40OSi and a molecular weight of 336.64 g/mol. Its IUPAC name is [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane
PubChem CID135020086
Molecular FormulaC21H40OSi
Molecular Weight336.64 g/mol
Exact Mass336.28
IUPAC Name[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane
SMILESC=CC[C@@]1(C)CC[C@H](C(=C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H40OSi/c1-11-13-21(10)14-12-19(15(2)3)20(21)22-23(16(4)5,17(6)7)18(8)9/h11,16-20H,1-2,12-14H2,3-10H3/t19-,20-,21+/m1/s1
InChIKeyVTVWFACJWFMEHC-NJYVYQBISA-N
XLogP7.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.64
LogP ≤ 57.12
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

[(1S,2S,3R)-2-(2,2-dimethylpent-4-enyl)-3-methyl-1-(2-methylprop-2-enyl)cyclopentyl]oxy-trimethylsilane
CID 10734653
[(1R,2R,3S)-2-(2,2-dimethylpent-4-enyl)-3-methyl-1-[2-(trimethylsilylmethyl)prop-2-enyl]cyclopentyl]oxy-trimethylsilane
CID 49818552
[(1S,2R,5S)-2-ethenyl-2-methyl-5-prop-1-en-2-ylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 57326161
2-[[Tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol
CID 72665366
trimethyl-[2-methyl-4-[(1R,2S,3S)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]butan-2-yl]oxysilane
CID 101866138
trimethyl-[2-methyl-4-[(1R,2R,3R)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]butan-2-yl]oxysilane
CID 135020039
tert-butyl-dimethyl-[[(1R,2S,3S)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]methoxy]silane
CID 135020040
tert-butyl-dimethyl-[[(1R,2R,3R)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]methoxy]silane
CID 135020041
[(1R,2R,5R)-2-ethenyl-2-methyl-5-prop-1-en-2-ylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 135020042
[(1S,2R,5S)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 135020085
tert-butyl-dimethyl-[[(1S,2R,3R)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]methoxy]silane
CID 135020514
tert-butyl-dimethyl-[[(1S,2S,3S)-1-methyl-3-prop-1-en-2-yl-2-tri(propan-2-yl)silyloxycyclopentyl]methoxy]silane
CID 135020515

Frequently Asked Questions

What is the IUPAC name of [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane (CID 135020086) is [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane is C=CC[C@@]1(C)CC[C@H](C(=C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane?
The InChIKey is VTVWFACJWFMEHC-NJYVYQBISA-N. The full InChI is InChI=1S/C21H40OSi/c1-11-13-21(10)14-12-19(15(2)3)20(21)22-23(16(4)5,17(6)7)18(8)9/h11,16-20H,1-2,12-14H2,3-10H3/t19-,20-,21+/m1/s1.
What are the key properties of [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane?
[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane has a molecular weight of 336.64 g/mol, XLogP of 7.12, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 135020086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).