iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane

C25H45IN2Sn — CID 157148080

IUPACiodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane
SMILESC.CCCC[Sn](CCCC)(CCCC)c1ccccn1.CI.Cc1ccccn1
InChIInChI=1S/C6H7N.C5H4N.3C4H9.CH3I.CH4.Sn/c1-6-4-2-3-5-7-6;1-2-4-6-5-3-1;3*1-3-4-2;1-2;;/h2-5H,1H3;1-4H;3*1,3-4H2,2H3;1H3;1H4;
InChIKeyAKXXLIMZVHXLLC-UHFFFAOYSA-N
MW619.26 g/mol
LogP8.22
Rot. Bonds10

About iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane

iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane (PubChem CID 157148080) has the molecular formula C25H45IN2Sn and a molecular weight of 619.26 g/mol. Its IUPAC name is iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane.

Molecular Properties

Compound Nameiodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane
PubChem CID157148080
Molecular FormulaC25H45IN2Sn
Molecular Weight619.26 g/mol
Exact Mass620.16
IUPAC Nameiodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane
SMILESC.CCCC[Sn](CCCC)(CCCC)c1ccccn1.CI.Cc1ccccn1
InChIInChI=1S/C6H7N.C5H4N.3C4H9.CH3I.CH4.Sn/c1-6-4-2-3-5-7-6;1-2-4-6-5-3-1;3*1-3-4-2;1-2;;/h2-5H,1H3;1-4H;3*1,3-4H2,2H3;1H3;1H4;
InChIKeyAKXXLIMZVHXLLC-UHFFFAOYSA-N
XLogP8.22
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500619.26
LogP ≤ 58.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

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tributyl-(4-phenyl-2-pyridinyl)stannane
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butyl-(4-methyl-2-pyridinyl)-dipentylstannane
CID 170630373
dichloroplatinum;bis(2-methylpyridine)
CID 4034453
tributyl-(2-chloro-3-pyridinyl)stannane
CID 10668839
2-ethylpyridine;2-methylpyridine
CID 19020939
magnesium;hydride;2-methylpyridine;hydroiodide
CID 174750573
2,2-dimethylpropane;2-methylpyridine
CID 159740552
2-butan-2-ylpyrimidine;2-methylpyridine
CID 142961647
1-butyl-4-methylpiperazine;ethane;2-methylpyridine
CID 144514964

Frequently Asked Questions

What is the IUPAC name of iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane?
The IUPAC name of iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane (CID 157148080) is iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane.
What is the SMILES notation for iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane?
The canonical SMILES for iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane is C.CCCC[Sn](CCCC)(CCCC)c1ccccn1.CI.Cc1ccccn1.
What is the InChIKey of iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane?
The InChIKey is AKXXLIMZVHXLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.C5H4N.3C4H9.CH3I.CH4.Sn/c1-6-4-2-3-5-7-6;1-2-4-6-5-3-1;3*1-3-4-2;1-2;;/h2-5H,1H3;1-4H;3*1,3-4H2,2H3;1H3;1H4;.
What are the key properties of iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane?
iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane has a molecular weight of 619.26 g/mol, XLogP of 8.22, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iodomethane;methane;2-methylpyridine;tributyl(pyridin-2-yl)stannane is sourced from PubChem (CID 157148080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).