tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane

C15H29FN2Sn — CID 11153044

IUPACtributyl-(4-fluoro-1H-pyrazol-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1[nH]ncc1F
InChIInChI=1S/3C4H9.C3H2FN2.Sn/c3*1-3-4-2;4-3-1-5-6-2-3;/h3*1,3-4H2,2H3;1H,(H,5,6);
InChIKeyNYIURNDNQVVBJK-UHFFFAOYSA-N
MW375.12 g/mol
LogP4.60
Rot. Bonds10

About tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane

tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane (PubChem CID 11153044) has the molecular formula C15H29FN2Sn and a molecular weight of 375.12 g/mol. Its IUPAC name is tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane.

Molecular Properties

Compound Nametributyl-(4-fluoro-1H-pyrazol-5-yl)stannane
PubChem CID11153044
Molecular FormulaC15H29FN2Sn
Molecular Weight375.12 g/mol
Exact Mass376.13
IUPAC Nametributyl-(4-fluoro-1H-pyrazol-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1[nH]ncc1F
InChIInChI=1S/3C4H9.C3H2FN2.Sn/c3*1-3-4-2;4-3-1-5-6-2-3;/h3*1,3-4H2,2H3;1H,(H,5,6);
InChIKeyNYIURNDNQVVBJK-UHFFFAOYSA-N
XLogP4.60
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.12
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane?
The IUPAC name of tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane (CID 11153044) is tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane.
What is the SMILES notation for tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane?
The canonical SMILES for tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1[nH]ncc1F.
What is the InChIKey of tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane?
The InChIKey is NYIURNDNQVVBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H9.C3H2FN2.Sn/c3*1-3-4-2;4-3-1-5-6-2-3;/h3*1,3-4H2,2H3;1H,(H,5,6);.
What are the key properties of tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane?
tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane has a molecular weight of 375.12 g/mol, XLogP of 4.60, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(4-fluoro-1H-pyrazol-5-yl)stannane is sourced from PubChem (CID 11153044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).