tributyl-(5-nonyl-2-pyridinyl)stannane

C26H49NSn — CID 155733782

IUPACtributyl-(5-nonyl-2-pyridinyl)stannane
SMILESCCCCCCCCCc1ccc([Sn](CCCC)(CCCC)CCCC)nc1
InChIInChI=1S/C14H22N.3C4H9.Sn/c1-2-3-4-5-6-7-8-10-14-11-9-12-15-13-14;3*1-3-4-2;/h9,11,13H,2-8,10H2,1H3;3*1,3-4H2,2H3;
InChIKeyYPTWYPURRVDXPG-UHFFFAOYSA-N
MW494.40 g/mol
LogP8.43
Rot. Bonds18

About tributyl-(5-nonyl-2-pyridinyl)stannane

tributyl-(5-nonyl-2-pyridinyl)stannane (PubChem CID 155733782) has the molecular formula C26H49NSn and a molecular weight of 494.40 g/mol. Its IUPAC name is tributyl-(5-nonyl-2-pyridinyl)stannane.

Molecular Properties

Compound Nametributyl-(5-nonyl-2-pyridinyl)stannane
PubChem CID155733782
Molecular FormulaC26H49NSn
Molecular Weight494.40 g/mol
Exact Mass495.29
IUPAC Nametributyl-(5-nonyl-2-pyridinyl)stannane
SMILESCCCCCCCCCc1ccc([Sn](CCCC)(CCCC)CCCC)nc1
InChIInChI=1S/C14H22N.3C4H9.Sn/c1-2-3-4-5-6-7-8-10-14-11-9-12-15-13-14;3*1-3-4-2;/h9,11,13H,2-8,10H2,1H3;3*1,3-4H2,2H3;
InChIKeyYPTWYPURRVDXPG-UHFFFAOYSA-N
XLogP8.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.40
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tributyl-[5-(2-methoxyethyl)-2-pyridinyl]stannane
CID 67415284
5-nonadecyl-2-(5-nonadecyl-2-pyridinyl)pyridine
CID 14048482
tributyl-[4-(9-chlorononyl)phenyl]stannane
CID 19991924
2-bromo-5-pentylpyridine
CID 170248675
5-heptyl-2-(4-octylphenyl)pyridine
CID 19841858
2-(4-hexylphenyl)-5-[2-(4-pentylphenyl)ethyl]pyridine
CID 19841822
5-hexyl-2-[4-[2-(4-hexylphenyl)ethyl]phenyl]pyridine
CID 19841812
5-octyl-2-(4-octylphenyl)pyrimidine
CID 18544772
5-tetradecyl-2-(4-tridecylphenyl)pyrimidine
CID 139803490
5-dodecyl-2-(4-hexylphenyl)pyrimidine
CID 139803450
5-heptyl-2-(4-tridecylphenyl)pyrimidine
CID 139803426
2-(4-dodecylphenyl)-5-pentadecylpyrimidine
CID 139803541

Frequently Asked Questions

What is the IUPAC name of tributyl-(5-nonyl-2-pyridinyl)stannane?
The IUPAC name of tributyl-(5-nonyl-2-pyridinyl)stannane (CID 155733782) is tributyl-(5-nonyl-2-pyridinyl)stannane.
What is the SMILES notation for tributyl-(5-nonyl-2-pyridinyl)stannane?
The canonical SMILES for tributyl-(5-nonyl-2-pyridinyl)stannane is CCCCCCCCCc1ccc([Sn](CCCC)(CCCC)CCCC)nc1.
What is the InChIKey of tributyl-(5-nonyl-2-pyridinyl)stannane?
The InChIKey is YPTWYPURRVDXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N.3C4H9.Sn/c1-2-3-4-5-6-7-8-10-14-11-9-12-15-13-14;3*1-3-4-2;/h9,11,13H,2-8,10H2,1H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(5-nonyl-2-pyridinyl)stannane?
tributyl-(5-nonyl-2-pyridinyl)stannane has a molecular weight of 494.40 g/mol, XLogP of 8.43, 18 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(5-nonyl-2-pyridinyl)stannane is sourced from PubChem (CID 155733782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).