1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone

C11H15NO2S — CID 167980764

IUPAC1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
SMILESCC(=O)N1CC(C)OC(c2ccsc2)C1
InChIInChI=1S/C11H15NO2S/c1-8-5-12(9(2)13)6-11(14-8)10-3-4-15-7-10/h3-4,7-8,11H,5-6H2,1-2H3
InChIKeyMYLIHIFOIMIJRR-UHFFFAOYSA-N
MW225.31 g/mol
LogP2.06
Rot. Bonds1

About 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone

1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone (PubChem CID 167980764) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
PubChem CID167980764
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
SMILESCC(=O)N1CC(C)OC(c2ccsc2)C1
InChIInChI=1S/C11H15NO2S/c1-8-5-12(9(2)13)6-11(14-8)10-3-4-15-7-10/h3-4,7-8,11H,5-6H2,1-2H3
InChIKeyMYLIHIFOIMIJRR-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)-1-[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]ethanone
CID 124686454
2-(1,3-dioxan-2-yl)-1-[(2S,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]ethanone
CID 125140010
(2R,6R)-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylmorpholine-4-carboxamide
CID 97074965
(3-aminocyclopentyl)-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)methanone
CID 119810914
[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 124694505
2-amino-3-methyl-1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pentan-1-one
CID 119810944
(9-amino-3-bicyclo[3.3.1]nonanyl)-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)methanone;hydrochloride
CID 120992573
(2R,6S)-N-(5-methoxy-1,3,4-thiadiazol-2-yl)-2-methyl-6-thiophen-3-ylmorpholine-4-carboxamide
CID 125138480
[(2R,6S)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
CID 125135325
N-(furan-2-ylmethyl)-2-methyl-6-thiophen-3-ylmorpholine-4-carboxamide
CID 71919520
2-methyl-N-(pyridin-2-ylmethyl)-6-thiophen-3-ylmorpholine-4-carboxamide
CID 71919519
1H-indol-7-yl-[(2S,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]methanone
CID 124592372

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone?
The IUPAC name of 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone (CID 167980764) is 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone.
What is the SMILES notation for 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone?
The canonical SMILES for 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone is CC(=O)N1CC(C)OC(c2ccsc2)C1.
What is the InChIKey of 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone?
The InChIKey is MYLIHIFOIMIJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-8-5-12(9(2)13)6-11(14-8)10-3-4-15-7-10/h3-4,7-8,11H,5-6H2,1-2H3.
What are the key properties of 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone?
1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone has a molecular weight of 225.31 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone is sourced from PubChem (CID 167980764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).