tributyl-(2-chloro-3-pyridinyl)stannane

C17H30ClNSn — CID 10668839

IUPACtributyl-(2-chloro-3-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cccnc1Cl
InChIInChI=1S/C5H3ClN.3C4H9.Sn/c6-5-3-1-2-4-7-5;3*1-3-4-2;/h1-2,4H;3*1,3-4H2,2H3;
InChIKeyQVMCNKXAMXHRPU-UHFFFAOYSA-N
MW402.60 g/mol
LogP5.79
Rot. Bonds10

About tributyl-(2-chloro-3-pyridinyl)stannane

tributyl-(2-chloro-3-pyridinyl)stannane (PubChem CID 10668839) has the molecular formula C17H30ClNSn and a molecular weight of 402.60 g/mol. Its IUPAC name is tributyl-(2-chloro-3-pyridinyl)stannane.

Molecular Properties

Compound Nametributyl-(2-chloro-3-pyridinyl)stannane
PubChem CID10668839
Molecular FormulaC17H30ClNSn
Molecular Weight402.60 g/mol
Exact Mass403.11
IUPAC Nametributyl-(2-chloro-3-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cccnc1Cl
InChIInChI=1S/C5H3ClN.3C4H9.Sn/c6-5-3-1-2-4-7-5;3*1-3-4-2;/h1-2,4H;3*1,3-4H2,2H3;
InChIKeyQVMCNKXAMXHRPU-UHFFFAOYSA-N
XLogP5.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.60
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-3-pentylpyridine
CID 54505218
tributyl-[2-(6-phenyl-4-tributylstannylpyridazin-3-yl)-3-pyridinyl]stannane
CID 86079466
2-chloro-3-dodecylpyridine
CID 54546812
tributyl-(4-chloro-3-pyridinyl)stannane
CID 10811131
2-chloro-3-hexylpyridine
CID 54056214
N-[(2-chloro-3-pyridinyl)methyl]-N-methylbutan-1-amine
CID 62472154
N-[(2-chloro-3-pyridinyl)methyl]-N-methylpentan-1-amine
CID 62471625
tert-butyl-dimethyl-[2-methyl-4-(3-tributylstannyl-2-pyridinyl)but-3-yn-2-yl]oxysilane
CID 155641238
iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane
CID 157148080
tributyl-(1-methylpyrazolo[4,3-b]pyridin-3-yl)stannane
CID 71280467
trimethyl-[2-[(2-tributylstannyl-3-pyridinyl)oxymethoxy]ethyl]silane
CID 175958741
(1R)-1-(2-chloro-3-pyridinyl)hexan-1-amine
CID 171198991

Frequently Asked Questions

What is the IUPAC name of tributyl-(2-chloro-3-pyridinyl)stannane?
The IUPAC name of tributyl-(2-chloro-3-pyridinyl)stannane (CID 10668839) is tributyl-(2-chloro-3-pyridinyl)stannane.
What is the SMILES notation for tributyl-(2-chloro-3-pyridinyl)stannane?
The canonical SMILES for tributyl-(2-chloro-3-pyridinyl)stannane is CCCC[Sn](CCCC)(CCCC)c1cccnc1Cl.
What is the InChIKey of tributyl-(2-chloro-3-pyridinyl)stannane?
The InChIKey is QVMCNKXAMXHRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClN.3C4H9.Sn/c6-5-3-1-2-4-7-5;3*1-3-4-2;/h1-2,4H;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(2-chloro-3-pyridinyl)stannane?
tributyl-(2-chloro-3-pyridinyl)stannane has a molecular weight of 402.60 g/mol, XLogP of 5.79, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(2-chloro-3-pyridinyl)stannane is sourced from PubChem (CID 10668839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).