2-ethenyl-3-(2-methylpentan-2-yl)pyridine

C13H19N — CID 130178761

IUPAC2-ethenyl-3-(2-methylpentan-2-yl)pyridine
SMILESC=Cc1ncccc1C(C)(C)CCC
InChIInChI=1S/C13H19N/c1-5-9-13(3,4)11-8-7-10-14-12(11)6-2/h6-8,10H,2,5,9H2,1,3-4H3
InChIKeyZSKONBLQUMLJPL-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.80
Rot. Bonds4

About 2-ethenyl-3-(2-methylpentan-2-yl)pyridine

2-ethenyl-3-(2-methylpentan-2-yl)pyridine (PubChem CID 130178761) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-ethenyl-3-(2-methylpentan-2-yl)pyridine.

Molecular Properties

Compound Name2-ethenyl-3-(2-methylpentan-2-yl)pyridine
PubChem CID130178761
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name2-ethenyl-3-(2-methylpentan-2-yl)pyridine
SMILESC=Cc1ncccc1C(C)(C)CCC
InChIInChI=1S/C13H19N/c1-5-9-13(3,4)11-8-7-10-14-12(11)6-2/h6-8,10H,2,5,9H2,1,3-4H3
InChIKeyZSKONBLQUMLJPL-UHFFFAOYSA-N
XLogP3.80
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-3-(2-methylpentan-2-yl)pyridine?
The IUPAC name of 2-ethenyl-3-(2-methylpentan-2-yl)pyridine (CID 130178761) is 2-ethenyl-3-(2-methylpentan-2-yl)pyridine.
What is the SMILES notation for 2-ethenyl-3-(2-methylpentan-2-yl)pyridine?
The canonical SMILES for 2-ethenyl-3-(2-methylpentan-2-yl)pyridine is C=Cc1ncccc1C(C)(C)CCC.
What is the InChIKey of 2-ethenyl-3-(2-methylpentan-2-yl)pyridine?
The InChIKey is ZSKONBLQUMLJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-5-9-13(3,4)11-8-7-10-14-12(11)6-2/h6-8,10H,2,5,9H2,1,3-4H3.
What are the key properties of 2-ethenyl-3-(2-methylpentan-2-yl)pyridine?
2-ethenyl-3-(2-methylpentan-2-yl)pyridine has a molecular weight of 189.30 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-3-(2-methylpentan-2-yl)pyridine is sourced from PubChem (CID 130178761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).