tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane

C21H38N2OSn — CID 73357508

IUPACtributyl-(5-morpholin-4-yl-2-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C9H11N2O.3C4H9.Sn/c1-2-9(8-10-3-1)11-4-6-12-7-5-11;3*1-3-4-2;/h1-2,8H,4-7H2;3*1,3-4H2,2H3;
InChIKeyLOVBOQNZJJJQKF-UHFFFAOYSA-N
MW453.26 g/mol
LogP4.97
Rot. Bonds11

About tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane

tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane (PubChem CID 73357508) has the molecular formula C21H38N2OSn and a molecular weight of 453.26 g/mol. Its IUPAC name is tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane.

Molecular Properties

Compound Nametributyl-(5-morpholin-4-yl-2-pyridinyl)stannane
PubChem CID73357508
Molecular FormulaC21H38N2OSn
Molecular Weight453.26 g/mol
Exact Mass454.20
IUPAC Nametributyl-(5-morpholin-4-yl-2-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C9H11N2O.3C4H9.Sn/c1-2-9(8-10-3-1)11-4-6-12-7-5-11;3*1-3-4-2;/h1-2,8H,4-7H2;3*1,3-4H2,2H3;
InChIKeyLOVBOQNZJJJQKF-UHFFFAOYSA-N
XLogP4.97
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.26
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane?
The IUPAC name of tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane (CID 73357508) is tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane.
What is the SMILES notation for tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane?
The canonical SMILES for tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane is CCCC[Sn](CCCC)(CCCC)c1ccc(N2CCOCC2)cn1.
What is the InChIKey of tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane?
The InChIKey is LOVBOQNZJJJQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N2O.3C4H9.Sn/c1-2-9(8-10-3-1)11-4-6-12-7-5-11;3*1-3-4-2;/h1-2,8H,4-7H2;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane?
tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane has a molecular weight of 453.26 g/mol, XLogP of 4.97, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(5-morpholin-4-yl-2-pyridinyl)stannane is sourced from PubChem (CID 73357508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).