[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane

C18H23NSi — CID 140669508

IUPAC[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane
SMILESC[Si](C)(C)c1cc2ccccc2nc1C1=CCCCC1
InChIInChI=1S/C18H23NSi/c1-20(2,3)17-13-15-11-7-8-12-16(15)19-18(17)14-9-5-4-6-10-14/h7-9,11-13H,4-6,10H2,1-3H3
InChIKeyVPECHNYZCLWWOL-UHFFFAOYSA-N
MW281.47 g/mol
LogP4.74
Rot. Bonds2

About [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane

[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane (PubChem CID 140669508) has the molecular formula C18H23NSi and a molecular weight of 281.47 g/mol. Its IUPAC name is [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane.

Molecular Properties

Compound Name[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane
PubChem CID140669508
Molecular FormulaC18H23NSi
Molecular Weight281.47 g/mol
Exact Mass281.16
IUPAC Name[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane
SMILESC[Si](C)(C)c1cc2ccccc2nc1C1=CCCCC1
InChIInChI=1S/C18H23NSi/c1-20(2,3)17-13-15-11-7-8-12-16(15)19-18(17)14-9-5-4-6-10-14/h7-9,11-13H,4-6,10H2,1-3H3
InChIKeyVPECHNYZCLWWOL-UHFFFAOYSA-N
XLogP4.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane?
The IUPAC name of [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane (CID 140669508) is [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane.
What is the SMILES notation for [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane?
The canonical SMILES for [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane is C[Si](C)(C)c1cc2ccccc2nc1C1=CCCCC1.
What is the InChIKey of [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane?
The InChIKey is VPECHNYZCLWWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NSi/c1-20(2,3)17-13-15-11-7-8-12-16(15)19-18(17)14-9-5-4-6-10-14/h7-9,11-13H,4-6,10H2,1-3H3.
What are the key properties of [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane?
[2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane has a molecular weight of 281.47 g/mol, XLogP of 4.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexen-1-yl)quinolin-3-yl]-trimethylsilane is sourced from PubChem (CID 140669508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).