cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol

C17H34O2Si — CID 102196549

IUPACcis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol
SMILESCC(C)=C1C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)C[C@H]1O
InChIInChI=1S/C17H34O2Si/c1-11(2)16-9-15(10-17(16)18)19-20(12(3)4,13(5)6)14(7)8/h12-15,17-18H,9-10H2,1-8H3/t15-,17-/m1/s1
InChIKeyFFGKEGWXRZFNAV-NVXWUHKLSA-N
MW298.54 g/mol
LogP5.04
Rot. Bonds5

About cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol

cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol (PubChem CID 102196549) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol
PubChem CID102196549
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Namecis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol
SMILESCC(C)=C1C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)C[C@H]1O
InChIInChI=1S/C17H34O2Si/c1-11(2)16-9-15(10-17(16)18)19-20(12(3)4,13(5)6)14(7)8/h12-15,17-18H,9-10H2,1-8H3/t15-,17-/m1/s1
InChIKeyFFGKEGWXRZFNAV-NVXWUHKLSA-N
XLogP5.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.54
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

(4S,6R)-4-hydroxy-6-tri(propan-2-yl)silyloxycyclohept-2-en-1-one
CID 10990189
[3-tri(propan-2-yl)silyloxycyclopentanecarbonyl] 3-tri(propan-2-yl)silyloxycyclopentane-1-carboxylate
CID 141308142
(3-methylidenecyclohexyl)oxy-tri(propan-2-yl)silane
CID 11184751
5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one
CID 86703131
2-phenylmethoxy-4-tri(propan-2-yl)silyloxycyclopentan-1-ol
CID 169088344
[(3S)-1-hydroxypyrrolidin-3-yl]oxy-tri(propan-2-yl)silane
CID 11747324
acetic acid;(1R,4S)-4-tri(propan-2-yl)silyloxycyclopent-2-en-1-ol
CID 71355555
(1S)-2-propan-2-ylidenecyclobutan-1-ol
CID 100962891
(1'R,2'R,5'S,6'S)-8'-tri(propan-2-yl)silyloxyspiro[cyclopropane-1,11'-tricyclo[4.3.1.12,5]undec-3-ene]-10'-one
CID 146020448
tert-butyl-dimethyl-[(1R,6R)-6-tri(propan-2-yl)silyloxycyclohept-3-en-1-yl]oxysilane
CID 102052246
ethyl 4-tri(propan-2-yl)silyloxycyclohexane-1-carboxylate
CID 58512387
(1S,2S,5S,6S,7R)-2,5,7-trimethyl-6-tri(propan-2-yl)silyloxycyclohept-3-en-1-ol
CID 11255876

Frequently Asked Questions

What is the IUPAC name of cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol?
The IUPAC name of cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol (CID 102196549) is cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol.
What is the SMILES notation for cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol?
The canonical SMILES for cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol is CC(C)=C1C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)C[C@H]1O.
What is the InChIKey of cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol?
The InChIKey is FFGKEGWXRZFNAV-NVXWUHKLSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-11(2)16-9-15(10-17(16)18)19-20(12(3)4,13(5)6)14(7)8/h12-15,17-18H,9-10H2,1-8H3/t15-,17-/m1/s1.
What are the key properties of cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol?
cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol has a molecular weight of 298.54 g/mol, XLogP of 5.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,4R)-2-propan-2-ylidene-4-tri(propan-2-yl)silyloxycyclopentan-1-ol is sourced from PubChem (CID 102196549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).