tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane

C18H37NSn — CID 20609037

IUPACtributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)C1=CCN(C)CC1
InChIInChI=1S/C6H10N.3C4H9.Sn/c1-7-5-3-2-4-6-7;3*1-3-4-2;/h3H,4-6H2,1H3;3*1,3-4H2,2H3;
InChIKeyKOMSDINQZWKPJF-UHFFFAOYSA-N
MW386.21 g/mol
LogP5.64
Rot. Bonds10

About tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane

tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane (PubChem CID 20609037) has the molecular formula C18H37NSn and a molecular weight of 386.21 g/mol. Its IUPAC name is tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane.

Molecular Properties

Compound Nametributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane
PubChem CID20609037
Molecular FormulaC18H37NSn
Molecular Weight386.21 g/mol
Exact Mass387.19
IUPAC Nametributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)C1=CCN(C)CC1
InChIInChI=1S/C6H10N.3C4H9.Sn/c1-7-5-3-2-4-6-7;3*1-3-4-2;/h3H,4-6H2,1H3;3*1,3-4H2,2H3;
InChIKeyKOMSDINQZWKPJF-UHFFFAOYSA-N
XLogP5.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.21
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane?
The IUPAC name of tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane (CID 20609037) is tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane.
What is the SMILES notation for tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane?
The canonical SMILES for tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane is CCCC[Sn](CCCC)(CCCC)C1=CCN(C)CC1.
What is the InChIKey of tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane?
The InChIKey is KOMSDINQZWKPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N.3C4H9.Sn/c1-7-5-3-2-4-6-7;3*1-3-4-2;/h3H,4-6H2,1H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane?
tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane has a molecular weight of 386.21 g/mol, XLogP of 5.64, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)stannane is sourced from PubChem (CID 20609037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).