tributyl-(5-methyl-1,3-oxazol-2-yl)stannane

C16H31NOSn — CID 71307795

IUPACtributyl-(5-methyl-1,3-oxazol-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ncc(C)o1
InChIInChI=1S/C4H4NO.3C4H9.Sn/c1-4-2-5-3-6-4;3*1-3-4-2;/h2H,1H3;3*1,3-4H2,2H3;
InChIKeyUIYGJGQTZRONNB-UHFFFAOYSA-N
MW372.14 g/mol
LogP5.04
Rot. Bonds10

About tributyl-(5-methyl-1,3-oxazol-2-yl)stannane

tributyl-(5-methyl-1,3-oxazol-2-yl)stannane (PubChem CID 71307795) has the molecular formula C16H31NOSn and a molecular weight of 372.14 g/mol. Its IUPAC name is tributyl-(5-methyl-1,3-oxazol-2-yl)stannane.

Molecular Properties

Compound Nametributyl-(5-methyl-1,3-oxazol-2-yl)stannane
PubChem CID71307795
Molecular FormulaC16H31NOSn
Molecular Weight372.14 g/mol
Exact Mass373.14
IUPAC Nametributyl-(5-methyl-1,3-oxazol-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ncc(C)o1
InChIInChI=1S/C4H4NO.3C4H9.Sn/c1-4-2-5-3-6-4;3*1-3-4-2;/h2H,1H3;3*1,3-4H2,2H3;
InChIKeyUIYGJGQTZRONNB-UHFFFAOYSA-N
XLogP5.04
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.14
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of tributyl-(5-methyl-1,3-oxazol-2-yl)stannane?
The IUPAC name of tributyl-(5-methyl-1,3-oxazol-2-yl)stannane (CID 71307795) is tributyl-(5-methyl-1,3-oxazol-2-yl)stannane.
What is the SMILES notation for tributyl-(5-methyl-1,3-oxazol-2-yl)stannane?
The canonical SMILES for tributyl-(5-methyl-1,3-oxazol-2-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1ncc(C)o1.
What is the InChIKey of tributyl-(5-methyl-1,3-oxazol-2-yl)stannane?
The InChIKey is UIYGJGQTZRONNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4NO.3C4H9.Sn/c1-4-2-5-3-6-4;3*1-3-4-2;/h2H,1H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(5-methyl-1,3-oxazol-2-yl)stannane?
tributyl-(5-methyl-1,3-oxazol-2-yl)stannane has a molecular weight of 372.14 g/mol, XLogP of 5.04, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(5-methyl-1,3-oxazol-2-yl)stannane is sourced from PubChem (CID 71307795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).