3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane

C11H18Si — CID 173301983

IUPAC3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane
SMILESC[Si](C)(C)C#CCC1=CCCC1
InChIInChI=1S/C11H18Si/c1-12(2,3)10-6-9-11-7-4-5-8-11/h7H,4-5,8-9H2,1-3H3
InChIKeyJBKNTVBBCKEBJQ-UHFFFAOYSA-N
MW178.35 g/mol
LogP3.37
Rot. Bonds1

About 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane

3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane (PubChem CID 173301983) has the molecular formula C11H18Si and a molecular weight of 178.35 g/mol. Its IUPAC name is 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane.

Molecular Properties

Compound Name3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane
PubChem CID173301983
Molecular FormulaC11H18Si
Molecular Weight178.35 g/mol
Exact Mass178.12
IUPAC Name3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane
SMILESC[Si](C)(C)C#CCC1=CCCC1
InChIInChI=1S/C11H18Si/c1-12(2,3)10-6-9-11-7-4-5-8-11/h7H,4-5,8-9H2,1-3H3
InChIKeyJBKNTVBBCKEBJQ-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.35
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(1-Cyclohexen-1-ylethynyl)trimethylsilane
CID 11816203
1-[2-(Trimethylsilyl)ethynyl]cyclopentene
CID 12778987
Silane, (1-cyclohexen-1-ylmethyl)trimethyl-
CID 10964921
2-(Cyclohexen-1-yl)ethynyl-triethyl-silane
CID 134948291
[(4E)-5,9-dimethyldeca-4,8-dien-1-ynyl]-trimethylsilane
CID 10354026
trimethyl-[(5E,9E,13E,17E)-6,10,14,18,22-pentamethyltricosa-5,9,13,17,21-pentaen-1-ynyl]silane
CID 11015863
2-(Cyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 101856172
2-(Cyclopenten-1-yl)ethyl-trimethylsilane
CID 139263552
[(5E)-6,10-dimethylundeca-5,9-dien-1-ynyl]-trimethylsilane
CID 12489209
(3-Trimethylsilanyl-prop-2-ynylidene)-cyclohexane
CID 12750871
Silane, trimethyl(6-methyl-5-hepten-1-ynyl)-
CID 550064
Cyclopentene, 1-trimethylsilyl-2-methyl-4-methylene-
CID 552257

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane?
The IUPAC name of 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane (CID 173301983) is 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane.
What is the SMILES notation for 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane?
The canonical SMILES for 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane is C[Si](C)(C)C#CCC1=CCCC1.
What is the InChIKey of 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane?
The InChIKey is JBKNTVBBCKEBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Si/c1-12(2,3)10-6-9-11-7-4-5-8-11/h7H,4-5,8-9H2,1-3H3.
What are the key properties of 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane?
3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane has a molecular weight of 178.35 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopenten-1-yl)prop-1-ynyl-trimethylsilane is sourced from PubChem (CID 173301983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).