2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol

C14H26OSi — CID 134861774

IUPAC2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol
SMILESC=CC/C(=C1/CCCC1CCO)[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-7-14(16(2,3)4)13-9-6-8-12(13)10-11-15/h5,12,15H,1,6-11H2,2-4H3/b14-13+
InChIKeyZEUFBROXURHUHU-BUHFOSPRSA-N
MW238.45 g/mol
LogP3.92
Rot. Bonds5

About 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol

2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol (PubChem CID 134861774) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol.

Molecular Properties

Compound Name2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol
PubChem CID134861774
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol
SMILESC=CC/C(=C1/CCCC1CCO)[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-7-14(16(2,3)4)13-9-6-8-12(13)10-11-15/h5,12,15H,1,6-11H2,2-4H3/b14-13+
InChIKeyZEUFBROXURHUHU-BUHFOSPRSA-N
XLogP3.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 53.92
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol?
The IUPAC name of 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol (CID 134861774) is 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol.
What is the SMILES notation for 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol?
The canonical SMILES for 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol is C=CC/C(=C1/CCCC1CCO)[Si](C)(C)C.
What is the InChIKey of 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol?
The InChIKey is ZEUFBROXURHUHU-BUHFOSPRSA-N. The full InChI is InChI=1S/C14H26OSi/c1-5-7-14(16(2,3)4)13-9-6-8-12(13)10-11-15/h5,12,15H,1,6-11H2,2-4H3/b14-13+.
What are the key properties of 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol?
2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol has a molecular weight of 238.45 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2E)-2-(1-trimethylsilylbut-3-enylidene)cyclopentyl]ethanol is sourced from PubChem (CID 134861774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).