2-(3-ethylazetidin-1-yl)-5-methoxypyridine

C11H16N2O — CID 154695178

IUPAC2-(3-ethylazetidin-1-yl)-5-methoxypyridine
SMILESCCC1CN(c2ccc(OC)cn2)C1
InChIInChI=1S/C11H16N2O/c1-3-9-7-13(8-9)11-5-4-10(14-2)6-12-11/h4-6,9H,3,7-8H2,1-2H3
InChIKeyXKHYCNRDZHCXCT-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.94
Rot. Bonds3

About 2-(3-ethylazetidin-1-yl)-5-methoxypyridine

2-(3-ethylazetidin-1-yl)-5-methoxypyridine (PubChem CID 154695178) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(3-ethylazetidin-1-yl)-5-methoxypyridine.

Molecular Properties

Compound Name2-(3-ethylazetidin-1-yl)-5-methoxypyridine
PubChem CID154695178
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(3-ethylazetidin-1-yl)-5-methoxypyridine
SMILESCCC1CN(c2ccc(OC)cn2)C1
InChIInChI=1S/C11H16N2O/c1-3-9-7-13(8-9)11-5-4-10(14-2)6-12-11/h4-6,9H,3,7-8H2,1-2H3
InChIKeyXKHYCNRDZHCXCT-UHFFFAOYSA-N
XLogP1.94
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylazetidin-1-yl)-5-methoxypyridine?
The IUPAC name of 2-(3-ethylazetidin-1-yl)-5-methoxypyridine (CID 154695178) is 2-(3-ethylazetidin-1-yl)-5-methoxypyridine.
What is the SMILES notation for 2-(3-ethylazetidin-1-yl)-5-methoxypyridine?
The canonical SMILES for 2-(3-ethylazetidin-1-yl)-5-methoxypyridine is CCC1CN(c2ccc(OC)cn2)C1.
What is the InChIKey of 2-(3-ethylazetidin-1-yl)-5-methoxypyridine?
The InChIKey is XKHYCNRDZHCXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-9-7-13(8-9)11-5-4-10(14-2)6-12-11/h4-6,9H,3,7-8H2,1-2H3.
What are the key properties of 2-(3-ethylazetidin-1-yl)-5-methoxypyridine?
2-(3-ethylazetidin-1-yl)-5-methoxypyridine has a molecular weight of 192.26 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylazetidin-1-yl)-5-methoxypyridine is sourced from PubChem (CID 154695178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).