5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine

C11H14N2O — CID 22961867

IUPAC5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine
SMILESC=Cc1ccc(OC[C@@H]2CCN2)cn1
InChIInChI=1S/C11H14N2O/c1-2-9-3-4-11(7-13-9)14-8-10-5-6-12-10/h2-4,7,10,12H,1,5-6,8H2/t10-/m0/s1
InChIKeyLRWNKRYOAPGXTF-JTQLQIEISA-N
MW190.25 g/mol
LogP1.47
Rot. Bonds4

About 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine

5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine (PubChem CID 22961867) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine.

Molecular Properties

Compound Name5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine
PubChem CID22961867
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine
SMILESC=Cc1ccc(OC[C@@H]2CCN2)cn1
InChIInChI=1S/C11H14N2O/c1-2-9-3-4-11(7-13-9)14-8-10-5-6-12-10/h2-4,7,10,12H,1,5-6,8H2/t10-/m0/s1
InChIKeyLRWNKRYOAPGXTF-JTQLQIEISA-N
XLogP1.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine?
The IUPAC name of 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine (CID 22961867) is 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine.
What is the SMILES notation for 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine?
The canonical SMILES for 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine is C=Cc1ccc(OC[C@@H]2CCN2)cn1.
What is the InChIKey of 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine?
The InChIKey is LRWNKRYOAPGXTF-JTQLQIEISA-N. The full InChI is InChI=1S/C11H14N2O/c1-2-9-3-4-11(7-13-9)14-8-10-5-6-12-10/h2-4,7,10,12H,1,5-6,8H2/t10-/m0/s1.
What are the key properties of 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine?
5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine has a molecular weight of 190.25 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine is sourced from PubChem (CID 22961867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).