1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone

C14H14N2O2S — CID 122247181

IUPAC1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone
SMILESO=C(Cc1cccs1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C14H14N2O2S/c17-14(8-12-4-3-7-19-12)16-9-11(10-16)18-13-5-1-2-6-15-13/h1-7,11H,8-10H2
InChIKeyFWLKEFRQQYQAKG-UHFFFAOYSA-N
MW274.34 g/mol
LogP1.98
Rot. Bonds4

About 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone

1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone (PubChem CID 122247181) has the molecular formula C14H14N2O2S and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone.

Molecular Properties

Compound Name1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone
PubChem CID122247181
Molecular FormulaC14H14N2O2S
Molecular Weight274.34 g/mol
Exact Mass274.08
IUPAC Name1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone
SMILESO=C(Cc1cccs1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C14H14N2O2S/c17-14(8-12-4-3-7-19-12)16-9-11(10-16)18-13-5-1-2-6-15-13/h1-7,11H,8-10H2
InChIKeyFWLKEFRQQYQAKG-UHFFFAOYSA-N
XLogP1.98
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[(3-bromo-2-pyridinyl)oxy]azetidin-1-yl]-2-thiophen-2-ylethanone
CID 122249966
2-thiophen-2-yl-1-[3-[[6-(trifluoromethyl)-2-pyridinyl]oxy]azetidin-1-yl]ethanone
CID 122251883
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247174
1-(3-pyridin-2-ylpyrrolidin-1-yl)-2-thiophen-2-ylethanone
CID 71801548
1-[3-(3-chlorophenoxy)azetidin-1-yl]-2-thiophen-2-ylethanone
CID 77090716
(3-pyridin-2-yloxyazetidin-1-yl)-(1-thiophen-2-ylcyclopentyl)methanone
CID 122247258
1-[3-(2-methylpyrimidin-4-yl)oxypiperidin-1-yl]-2-thiophen-2-ylethanone
CID 122243623
3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one
CID 122247079
2-(2-methylphenoxy)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247163
1-[(2S,6R)-4-azatricyclo[5.2.2.02,6]undecan-4-yl]-2-thiophen-2-ylethanone
CID 56866059
(5-chlorothiophen-2-yl)-(3-pyridin-2-yloxyazetidin-1-yl)methanone
CID 122247268
2-thiophen-2-yl-1-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]ethanone
CID 110364980

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone?
The IUPAC name of 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone (CID 122247181) is 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone.
What is the SMILES notation for 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone?
The canonical SMILES for 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone is O=C(Cc1cccs1)N1CC(Oc2ccccn2)C1.
What is the InChIKey of 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone?
The InChIKey is FWLKEFRQQYQAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c17-14(8-12-4-3-7-19-12)16-9-11(10-16)18-13-5-1-2-6-15-13/h1-7,11H,8-10H2.
What are the key properties of 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone?
1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone has a molecular weight of 274.34 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone is sourced from PubChem (CID 122247181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).