2-prop-2-enylpyridine;tributyl(fluoro)stannane

C20H36FNSn — CID 174480224

IUPAC2-prop-2-enylpyridine;tributyl(fluoro)stannane
SMILESC=CCc1ccccn1.CCCC[Sn](F)(CCCC)CCCC
InChIInChI=1S/C8H9N.3C4H9.FH.Sn/c1-2-5-8-6-3-4-7-9-8;3*1-3-4-2;;/h2-4,6-7H,1,5H2;3*1,3-4H2,2H3;1H;/q;;;;;+1/p-1
InChIKeyIVVQUODIXUQDJZ-UHFFFAOYSA-M
MW428.22 g/mol
LogP7.11
Rot. Bonds11

About 2-prop-2-enylpyridine;tributyl(fluoro)stannane

2-prop-2-enylpyridine;tributyl(fluoro)stannane (PubChem CID 174480224) has the molecular formula C20H36FNSn and a molecular weight of 428.22 g/mol. Its IUPAC name is 2-prop-2-enylpyridine;tributyl(fluoro)stannane.

Molecular Properties

Compound Name2-prop-2-enylpyridine;tributyl(fluoro)stannane
PubChem CID174480224
Molecular FormulaC20H36FNSn
Molecular Weight428.22 g/mol
Exact Mass429.19
IUPAC Name2-prop-2-enylpyridine;tributyl(fluoro)stannane
SMILESC=CCc1ccccn1.CCCC[Sn](F)(CCCC)CCCC
InChIInChI=1S/C8H9N.3C4H9.FH.Sn/c1-2-5-8-6-3-4-7-9-8;3*1-3-4-2;;/h2-4,6-7H,1,5H2;3*1,3-4H2,2H3;1H;/q;;;;;+1/p-1
InChIKeyIVVQUODIXUQDJZ-UHFFFAOYSA-M
XLogP7.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.22
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-prop-2-enylpyridine
CID 3015241
hexadecyl(trimethyl)azanium;2-prop-2-enylpyridine;chloride
CID 174935769
CID 66669094
CID 66669094
fluoro(triphenyl)stannane;tributyl(fluoro)stannane
CID 160888992
butyl(pyridin-2-ylmethyl)azanium
CID 40508011
2-undecylpyridine
CID 66882765
2-hexadecylpyridine;hydrate
CID 141211108
chromium;2-pentylpyridine;hydrochloride
CID 175220071
2-tetradecylpyridine;hydrochloride
CID 45489746
N-propyl-2-pyridin-2-ylethanimine
CID 66967042
azanium;2-tetradecylpyridine;bromide
CID 157411341
1-chlorotetradecane;2-ethylpyridine
CID 160860410

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enylpyridine;tributyl(fluoro)stannane?
The IUPAC name of 2-prop-2-enylpyridine;tributyl(fluoro)stannane (CID 174480224) is 2-prop-2-enylpyridine;tributyl(fluoro)stannane.
What is the SMILES notation for 2-prop-2-enylpyridine;tributyl(fluoro)stannane?
The canonical SMILES for 2-prop-2-enylpyridine;tributyl(fluoro)stannane is C=CCc1ccccn1.CCCC[Sn](F)(CCCC)CCCC.
What is the InChIKey of 2-prop-2-enylpyridine;tributyl(fluoro)stannane?
The InChIKey is IVVQUODIXUQDJZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H9N.3C4H9.FH.Sn/c1-2-5-8-6-3-4-7-9-8;3*1-3-4-2;;/h2-4,6-7H,1,5H2;3*1,3-4H2,2H3;1H;/q;;;;;+1/p-1.
What are the key properties of 2-prop-2-enylpyridine;tributyl(fluoro)stannane?
2-prop-2-enylpyridine;tributyl(fluoro)stannane has a molecular weight of 428.22 g/mol, XLogP of 7.11, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enylpyridine;tributyl(fluoro)stannane is sourced from PubChem (CID 174480224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).