3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol

C16H32O2Si — CID 85394039

IUPAC3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol
SMILESC=C1CCCC1(CCCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-14-9-7-10-16(14,11-8-12-17)13-18-19(5,6)15(2,3)4/h17H,1,7-13H2,2-6H3
InChIKeyIANDXBVSBVIWDK-UHFFFAOYSA-N
MW284.52 g/mol
LogP4.51
Rot. Bonds6

About 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol

3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol (PubChem CID 85394039) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol.

Molecular Properties

Compound Name3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol
PubChem CID85394039
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol
SMILESC=C1CCCC1(CCCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-14-9-7-10-16(14,11-8-12-17)13-18-19(5,6)15(2,3)4/h17H,1,7-13H2,2-6H3
InChIKeyIANDXBVSBVIWDK-UHFFFAOYSA-N
XLogP4.51
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.51
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

2-[4-[tert-butyl(dimethyl)silyl]oxybutyl]-2-prop-2-enylcyclopentan-1-one
CID 101059159
1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclobutan-1-ol
CID 70362766
tert-butyl-[[(1S,5R)-6,6-dimethyl-2-methylidene-1-bicyclo[3.1.0]hexanyl]methoxy]-dimethylsilane
CID 99771555
[1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
CID 59000904
2-but-3-enyl-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexane-1,3-dione
CID 101240480
4-[(1S,2S)-1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-prop-1-en-2-yl-2-triethylsilyloxycyclobutyl]butan-1-ol
CID 10694523
9-[3-[tert-butyl(dimethyl)silyl]oxy-1-(9-hydroxynonyl)cyclopentyl]nonan-1-ol
CID 140956897
8-[tert-butyl(dimethyl)silyl]oxyoctan-1-ol
CID 11043515
22-[tert-butyl(dimethyl)silyl]oxydocosan-1-ol
CID 15229755
(1R,2S,6S,7R,10S,14S)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,6-dimethyl-15-methylidenetetracyclo[8.6.0.01,14.02,7]hexadecan-13-one
CID 71608620
5-[tert-butyl(dimethyl)silyl]oxy-4-methylpentan-1-ol
CID 14758907
(3aS,7aR)-7a-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-methylidenespiro[2,3,3a,7-tetrahydro-1H-indene-5,1'-cyclopropane]-4-one
CID 11034576

Frequently Asked Questions

What is the IUPAC name of 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol?
The IUPAC name of 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol (CID 85394039) is 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol.
What is the SMILES notation for 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol?
The canonical SMILES for 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol is C=C1CCCC1(CCCO)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol?
The InChIKey is IANDXBVSBVIWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-14-9-7-10-16(14,11-8-12-17)13-18-19(5,6)15(2,3)4/h17H,1,7-13H2,2-6H3.
What are the key properties of 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol?
3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol has a molecular weight of 284.52 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylidenecyclopentyl]propan-1-ol is sourced from PubChem (CID 85394039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).