tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane

C18H36OSi — CID 99772048

IUPACtert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane
SMILESC=C1[C@H](C(C)C)CC[C@@]1(C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36OSi/c1-14(2)16-10-11-18(7,15(16)3)12-13-19-20(8,9)17(4,5)6/h14,16H,3,10-13H2,1-2,4-9H3/t16-,18-/m0/s1
InChIKeySHTRLRWFJDSBLT-WMZOPIPTSA-N
MW296.57 g/mol
LogP6.03
Rot. Bonds5

About tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane

tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane (PubChem CID 99772048) has the molecular formula C18H36OSi and a molecular weight of 296.57 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane
PubChem CID99772048
Molecular FormulaC18H36OSi
Molecular Weight296.57 g/mol
Exact Mass296.25
IUPAC Nametert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane
SMILESC=C1[C@H](C(C)C)CC[C@@]1(C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36OSi/c1-14(2)16-10-11-18(7,15(16)3)12-13-19-20(8,9)17(4,5)6/h14,16H,3,10-13H2,1-2,4-9H3/t16-,18-/m0/s1
InChIKeySHTRLRWFJDSBLT-WMZOPIPTSA-N
XLogP6.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.57
LogP ≤ 56.03
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-[2-[(1S,3R,5S)-1-methyl-2-methylidene-5-propan-2-yl-3-trimethylsilylcyclopentyl]ethoxy]silane
CID 11406012
Tert-butyl-[2-(2,2-dimethyl-6-methylidenecyclohexyl)ethoxy]-dimethylsilane
CID 14563308
[(1S,2R,5S)-2-ethenyl-2-methyl-5-prop-1-en-2-ylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 57326161
[(1R)-1-but-3-enyl-5,5-dimethyl-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-yl]methoxy-tert-butyl-dimethylsilane
CID 135015332
[(1R)-1-but-3-enyl-5,5-dimethyl-1,2,3,3a,4,6-hexahydropentalen-6a-id-2-yl]methoxy-tert-butyl-dimethylsilane
CID 135015486
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
[(1R,2R,5R)-2-methyl-5-prop-1-en-2-yl-2-prop-2-enylcyclopentyl]oxy-tri(propan-2-yl)silane
CID 135020086
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 tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane (CID 99772048) is tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane is C=C1[C@H](C(C)C)CC[C@@]1(C)CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane?
The InChIKey is SHTRLRWFJDSBLT-WMZOPIPTSA-N. The full InChI is InChI=1S/C18H36OSi/c1-14(2)16-10-11-18(7,15(16)3)12-13-19-20(8,9)17(4,5)6/h14,16H,3,10-13H2,1-2,4-9H3/t16-,18-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane?
tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane has a molecular weight of 296.57 g/mol, XLogP of 6.03, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-[(1S,3S)-1-methyl-2-methylidene-3-propan-2-ylcyclopentyl]ethoxy]silane is sourced from PubChem (CID 99772048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).