5-thiophen-2-ylmorpholin-3-one

C8H9NO2S — CID 126971724

IUPAC5-thiophen-2-ylmorpholin-3-one
SMILESO=C1COCC(c2cccs2)N1
InChIInChI=1S/C8H9NO2S/c10-8-5-11-4-6(9-8)7-2-1-3-12-7/h1-3,6H,4-5H2,(H,9,10)
InChIKeyDKNAAOSINDXXJW-UHFFFAOYSA-N
MW183.23 g/mol
LogP0.94
Rot. Bonds1

About 5-thiophen-2-ylmorpholin-3-one

5-thiophen-2-ylmorpholin-3-one (PubChem CID 126971724) has the molecular formula C8H9NO2S and a molecular weight of 183.23 g/mol. Its IUPAC name is 5-thiophen-2-ylmorpholin-3-one.

Molecular Properties

Compound Name5-thiophen-2-ylmorpholin-3-one
PubChem CID126971724
Molecular FormulaC8H9NO2S
Molecular Weight183.23 g/mol
Exact Mass183.04
IUPAC Name5-thiophen-2-ylmorpholin-3-one
SMILESO=C1COCC(c2cccs2)N1
InChIInChI=1S/C8H9NO2S/c10-8-5-11-4-6(9-8)7-2-1-3-12-7/h1-3,6H,4-5H2,(H,9,10)
InChIKeyDKNAAOSINDXXJW-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-6-thiophen-2-ylpiperidin-2-one
CID 83818747
(5S)-5-pyridin-2-ylmorpholin-3-one
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(5R)-5-(6-oxo-1H-pyridin-2-yl)morpholin-3-one
CID 130715121
(5S)-5-(2-oxo-1H-pyridin-3-yl)morpholin-3-one
CID 130634453
(2S)-2-thiophen-2-ylaziridine
CID 55263035
1,4-dithiophen-2-yl-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-3,6-dione
CID 77153151
4-thiophen-2-yl-1,3-oxazolidine-2,5-dione
CID 13312725
2-(5-oxomorpholin-3-yl)benzaldehyde
CID 115023845
(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one
CID 130658822
3-thiophen-2-yloxolan-2-one
CID 142704105
3-thiophen-2-ylpyrrolidine-2,5-dione
CID 67512850
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CID 7022116

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-ylmorpholin-3-one?
The IUPAC name of 5-thiophen-2-ylmorpholin-3-one (CID 126971724) is 5-thiophen-2-ylmorpholin-3-one.
What is the SMILES notation for 5-thiophen-2-ylmorpholin-3-one?
The canonical SMILES for 5-thiophen-2-ylmorpholin-3-one is O=C1COCC(c2cccs2)N1.
What is the InChIKey of 5-thiophen-2-ylmorpholin-3-one?
The InChIKey is DKNAAOSINDXXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2S/c10-8-5-11-4-6(9-8)7-2-1-3-12-7/h1-3,6H,4-5H2,(H,9,10).
What are the key properties of 5-thiophen-2-ylmorpholin-3-one?
5-thiophen-2-ylmorpholin-3-one has a molecular weight of 183.23 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-ylmorpholin-3-one is sourced from PubChem (CID 126971724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).