(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane

C8H11ClFNSn — CID 163323521

IUPAC(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane
SMILESC[Sn](C)(C)c1nc(Cl)ccc1F
InChIInChI=1S/C5H2ClFN.3CH3.Sn/c6-5-2-1-4(7)3-8-5;;;;/h1-2H;3*1H3;
InChIKeyYKZLQOFXHPWLGX-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.42
Rot. Bonds1

About (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane

(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane (PubChem CID 163323521) has the molecular formula C8H11ClFNSn and a molecular weight of 294.35 g/mol. Its IUPAC name is (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane.

Molecular Properties

Compound Name(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane
PubChem CID163323521
Molecular FormulaC8H11ClFNSn
Molecular Weight294.35 g/mol
Exact Mass294.96
IUPAC Name(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane
SMILESC[Sn](C)(C)c1nc(Cl)ccc1F
InChIInChI=1S/C5H2ClFN.3CH3.Sn/c6-5-2-1-4(7)3-8-5;;;;/h1-2H;3*1H3;
InChIKeyYKZLQOFXHPWLGX-UHFFFAOYSA-N
XLogP2.42
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane?
The IUPAC name of (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane (CID 163323521) is (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane.
What is the SMILES notation for (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane?
The canonical SMILES for (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane is C[Sn](C)(C)c1nc(Cl)ccc1F.
What is the InChIKey of (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane?
The InChIKey is YKZLQOFXHPWLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2ClFN.3CH3.Sn/c6-5-2-1-4(7)3-8-5;;;;/h1-2H;3*1H3;.
What are the key properties of (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane?
(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane has a molecular weight of 294.35 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane is sourced from PubChem (CID 163323521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).