tributyl-(2-propan-2-yltetrazol-5-yl)stannane

C16H34N4Sn — CID 141455462

IUPACtributyl-(2-propan-2-yltetrazol-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1nnn(C(C)C)n1
InChIInChI=1S/C4H7N4.3C4H9.Sn/c1-4(2)8-6-3-5-7-8;3*1-3-4-2;/h4H,1-2H3;3*1,3-4H2,2H3;
InChIKeyKMZSHGBMKJNUKX-UHFFFAOYSA-N
MW401.19 g/mol
LogP4.31
Rot. Bonds11

About tributyl-(2-propan-2-yltetrazol-5-yl)stannane

tributyl-(2-propan-2-yltetrazol-5-yl)stannane (PubChem CID 141455462) has the molecular formula C16H34N4Sn and a molecular weight of 401.19 g/mol. Its IUPAC name is tributyl-(2-propan-2-yltetrazol-5-yl)stannane.

Molecular Properties

Compound Nametributyl-(2-propan-2-yltetrazol-5-yl)stannane
PubChem CID141455462
Molecular FormulaC16H34N4Sn
Molecular Weight401.19 g/mol
Exact Mass402.18
IUPAC Nametributyl-(2-propan-2-yltetrazol-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1nnn(C(C)C)n1
InChIInChI=1S/C4H7N4.3C4H9.Sn/c1-4(2)8-6-3-5-7-8;3*1-3-4-2;/h4H,1-2H3;3*1,3-4H2,2H3;
InChIKeyKMZSHGBMKJNUKX-UHFFFAOYSA-N
XLogP4.31
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.19
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

tributyl-(1-propan-2-ylpyrazol-4-yl)stannane
CID 58266758
3-(2-propan-2-yltetrazol-5-yl)propan-1-amine
CID 84653524
2-(2-propan-2-yltetrazol-5-yl)acetonitrile
CID 84763253
2,5-di(propan-2-yl)tetrazole
CID 21054922
2-nonan-2-yl-5-propyltetrazole
CID 177419840
N-methyl-2-(2-propan-2-yltetrazol-5-yl)ethanamine
CID 84653523
3-(2-propan-2-yltetrazol-5-yl)butanoic acid
CID 84668247
2-propan-2-yl-5-(trichloromethyl)tetrazole
CID 69030664
5-butyl-1-propan-2-yl-4-propyltriazole
CID 69388505
tributyl-(1-methylpyrazol-3-yl)stannane
CID 19028447
tributyl-[5-[2-(2-tributylstannyltetrazol-5-yl)ethyl]tetrazol-2-yl]stannane
CID 177399056
tributyl-(6-chloro-9-methylpurin-2-yl)stannane
CID 10790034

Frequently Asked Questions

What is the IUPAC name of tributyl-(2-propan-2-yltetrazol-5-yl)stannane?
The IUPAC name of tributyl-(2-propan-2-yltetrazol-5-yl)stannane (CID 141455462) is tributyl-(2-propan-2-yltetrazol-5-yl)stannane.
What is the SMILES notation for tributyl-(2-propan-2-yltetrazol-5-yl)stannane?
The canonical SMILES for tributyl-(2-propan-2-yltetrazol-5-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1nnn(C(C)C)n1.
What is the InChIKey of tributyl-(2-propan-2-yltetrazol-5-yl)stannane?
The InChIKey is KMZSHGBMKJNUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N4.3C4H9.Sn/c1-4(2)8-6-3-5-7-8;3*1-3-4-2;/h4H,1-2H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(2-propan-2-yltetrazol-5-yl)stannane?
tributyl-(2-propan-2-yltetrazol-5-yl)stannane has a molecular weight of 401.19 g/mol, XLogP of 4.31, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(2-propan-2-yltetrazol-5-yl)stannane is sourced from PubChem (CID 141455462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).