triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane

C12H21NSSi — CID 154701908

IUPACtriethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane
SMILESCC[Si](/C=C/c1scnc1C)(CC)CC
InChIInChI=1S/C12H21NSSi/c1-5-15(6-2,7-3)9-8-12-11(4)13-10-14-12/h8-10H,5-7H2,1-4H3/b9-8+
InChIKeyIDOYNELRXAGRRJ-CMDGGOBGSA-N
MW239.46 g/mol
LogP4.51
Rot. Bonds5

About triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane

triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane (PubChem CID 154701908) has the molecular formula C12H21NSSi and a molecular weight of 239.46 g/mol. Its IUPAC name is triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane.

Molecular Properties

Compound Nametriethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane
PubChem CID154701908
Molecular FormulaC12H21NSSi
Molecular Weight239.46 g/mol
Exact Mass239.12
IUPAC Nametriethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane
SMILESCC[Si](/C=C/c1scnc1C)(CC)CC
InChIInChI=1S/C12H21NSSi/c1-5-15(6-2,7-3)9-8-12-11(4)13-10-14-12/h8-10H,5-7H2,1-4H3/b9-8+
InChIKeyIDOYNELRXAGRRJ-CMDGGOBGSA-N
XLogP4.51
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.46
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane?
The IUPAC name of triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane (CID 154701908) is triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane.
What is the SMILES notation for triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane?
The canonical SMILES for triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane is CC[Si](/C=C/c1scnc1C)(CC)CC.
What is the InChIKey of triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane?
The InChIKey is IDOYNELRXAGRRJ-CMDGGOBGSA-N. The full InChI is InChI=1S/C12H21NSSi/c1-5-15(6-2,7-3)9-8-12-11(4)13-10-14-12/h8-10H,5-7H2,1-4H3/b9-8+.
What are the key properties of triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane?
triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane has a molecular weight of 239.46 g/mol, XLogP of 4.51, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]silane is sourced from PubChem (CID 154701908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).