(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane

C9H13ClFNSi — CID 160916877

IUPAC(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane
SMILESCc1c(Cl)cnc([Si](C)(C)C)c1F
InChIInChI=1S/C9H13ClFNSi/c1-6-7(10)5-12-9(8(6)11)13(2,3)4/h5H,1-4H3
InChIKeySRNAXLOAOQAMHV-UHFFFAOYSA-N
MW217.75 g/mol
LogP2.73
Rot. Bonds1

About (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane

(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane (PubChem CID 160916877) has the molecular formula C9H13ClFNSi and a molecular weight of 217.75 g/mol. Its IUPAC name is (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane.

Molecular Properties

Compound Name(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane
PubChem CID160916877
Molecular FormulaC9H13ClFNSi
Molecular Weight217.75 g/mol
Exact Mass217.05
IUPAC Name(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane
SMILESCc1c(Cl)cnc([Si](C)(C)C)c1F
InChIInChI=1S/C9H13ClFNSi/c1-6-7(10)5-12-9(8(6)11)13(2,3)4/h5H,1-4H3
InChIKeySRNAXLOAOQAMHV-UHFFFAOYSA-N
XLogP2.73
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.75
LogP ≤ 52.73
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 (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane?
The IUPAC name of (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane (CID 160916877) is (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane.
What is the SMILES notation for (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane?
The canonical SMILES for (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane is Cc1c(Cl)cnc([Si](C)(C)C)c1F.
What is the InChIKey of (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane?
The InChIKey is SRNAXLOAOQAMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClFNSi/c1-6-7(10)5-12-9(8(6)11)13(2,3)4/h5H,1-4H3.
What are the key properties of (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane?
(5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane has a molecular weight of 217.75 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-3-fluoro-4-methyl-2-pyridinyl)-trimethylsilane is sourced from PubChem (CID 160916877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).