2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol

C16H32O2Si — CID 72665366

IUPAC2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol
SMILESC=C(C)C1CCC(C)(CO[Si](C)(C)C(C)(C)C)C1O
InChIInChI=1S/C16H32O2Si/c1-12(2)13-9-10-16(6,14(13)17)11-18-19(7,8)15(3,4)5/h13-14,17H,1,9-11H2,2-8H3
InChIKeyMQDRINXHDJAJRT-UHFFFAOYSA-N
MW284.52 g/mol
LogP4.36
Rot. Bonds4

About 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol

2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol (PubChem CID 72665366) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol.

Molecular Properties

Compound Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol
PubChem CID72665366
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol
SMILESC=C(C)C1CCC(C)(CO[Si](C)(C)C(C)(C)C)C1O
InChIInChI=1S/C16H32O2Si/c1-12(2)13-9-10-16(6,14(13)17)11-18-19(7,8)15(3,4)5/h13-14,17H,1,9-11H2,2-8H3
InChIKeyMQDRINXHDJAJRT-UHFFFAOYSA-N
XLogP4.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.36
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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Frequently Asked Questions

What is the IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol?
The IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol (CID 72665366) is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol.
What is the SMILES notation for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol?
The canonical SMILES for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol is C=C(C)C1CCC(C)(CO[Si](C)(C)C(C)(C)C)C1O.
What is the InChIKey of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol?
The InChIKey is MQDRINXHDJAJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-12(2)13-9-10-16(6,14(13)17)11-18-19(7,8)15(3,4)5/h13-14,17H,1,9-11H2,2-8H3.
What are the key properties of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol?
2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol has a molecular weight of 284.52 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methyl-5-prop-1-en-2-ylcyclopentan-1-ol is sourced from PubChem (CID 72665366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).