tributyl(pyrrol-1-yl)stannane

C16H31NSn — CID 22345222

IUPACtributyl(pyrrol-1-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)n1cccc1
InChIInChI=1S/C4H4N.3C4H9.Sn/c1-2-4-5-3-1;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3;/q-1;;;;+1
InChIKeyAQBBIUHRQXCYBO-UHFFFAOYSA-N
MW356.14 g/mol
LogP5.68
Rot. Bonds10

About tributyl(pyrrol-1-yl)stannane

tributyl(pyrrol-1-yl)stannane (PubChem CID 22345222) has the molecular formula C16H31NSn and a molecular weight of 356.14 g/mol. Its IUPAC name is tributyl(pyrrol-1-yl)stannane.

Molecular Properties

Compound Nametributyl(pyrrol-1-yl)stannane
PubChem CID22345222
Molecular FormulaC16H31NSn
Molecular Weight356.14 g/mol
Exact Mass357.15
IUPAC Nametributyl(pyrrol-1-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)n1cccc1
InChIInChI=1S/C4H4N.3C4H9.Sn/c1-2-4-5-3-1;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3;/q-1;;;;+1
InChIKeyAQBBIUHRQXCYBO-UHFFFAOYSA-N
XLogP5.68
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.14
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl(pyrrol-1-yl)stannane?
The IUPAC name of tributyl(pyrrol-1-yl)stannane (CID 22345222) is tributyl(pyrrol-1-yl)stannane.
What is the SMILES notation for tributyl(pyrrol-1-yl)stannane?
The canonical SMILES for tributyl(pyrrol-1-yl)stannane is CCCC[Sn](CCCC)(CCCC)n1cccc1.
What is the InChIKey of tributyl(pyrrol-1-yl)stannane?
The InChIKey is AQBBIUHRQXCYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N.3C4H9.Sn/c1-2-4-5-3-1;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3;/q-1;;;;+1.
What are the key properties of tributyl(pyrrol-1-yl)stannane?
tributyl(pyrrol-1-yl)stannane has a molecular weight of 356.14 g/mol, XLogP of 5.68, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(pyrrol-1-yl)stannane is sourced from PubChem (CID 22345222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).