(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane

C10H14BrNSi — CID 172815207

IUPAC(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane
SMILESC[Si](C)(C)C(Br)=Cc1ccncc1
InChIInChI=1S/C10H14BrNSi/c1-13(2,3)10(11)8-9-4-6-12-7-5-9/h4-8H,1-3H3
InChIKeySSHVAOHXYNVQGA-UHFFFAOYSA-N
MW256.22 g/mol
LogP3.69
Rot. Bonds2

About (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane

(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane (PubChem CID 172815207) has the molecular formula C10H14BrNSi and a molecular weight of 256.22 g/mol. Its IUPAC name is (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane.

Molecular Properties

Compound Name(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane
PubChem CID172815207
Molecular FormulaC10H14BrNSi
Molecular Weight256.22 g/mol
Exact Mass255.01
IUPAC Name(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane
SMILESC[Si](C)(C)C(Br)=Cc1ccncc1
InChIInChI=1S/C10H14BrNSi/c1-13(2,3)10(11)8-9-4-6-12-7-5-9/h4-8H,1-3H3
InChIKeySSHVAOHXYNVQGA-UHFFFAOYSA-N
XLogP3.69
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.22
LogP ≤ 53.69
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 (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane?
The IUPAC name of (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane (CID 172815207) is (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane.
What is the SMILES notation for (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane?
The canonical SMILES for (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane is C[Si](C)(C)C(Br)=Cc1ccncc1.
What is the InChIKey of (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane?
The InChIKey is SSHVAOHXYNVQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNSi/c1-13(2,3)10(11)8-9-4-6-12-7-5-9/h4-8H,1-3H3.
What are the key properties of (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane?
(1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane has a molecular weight of 256.22 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-bromo-2-pyridin-4-ylethenyl)-trimethylsilane is sourced from PubChem (CID 172815207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).