1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one

C11H16N2O2S — CID 116595810

IUPAC1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one
SMILESCc1csc(CC(=O)CC2COCCN2)n1
InChIInChI=1S/C11H16N2O2S/c1-8-7-16-11(13-8)5-10(14)4-9-6-15-3-2-12-9/h7,9,12H,2-6H2,1H3
InChIKeyUOTLSHZJIIVLGW-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.94
Rot. Bonds4

About 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one

1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one (PubChem CID 116595810) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one.

Molecular Properties

Compound Name1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one
PubChem CID116595810
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Name1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one
SMILESCc1csc(CC(=O)CC2COCCN2)n1
InChIInChI=1S/C11H16N2O2S/c1-8-7-16-11(13-8)5-10(14)4-9-6-15-3-2-12-9/h7,9,12H,2-6H2,1H3
InChIKeyUOTLSHZJIIVLGW-UHFFFAOYSA-N
XLogP0.94
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methyl-1,3-thiazol-2-yl)-3-piperidin-4-ylpropan-2-one
CID 116559994
1-morpholin-3-yl-3-pyridin-4-ylpropan-2-one
CID 116595856
1-(5-methylthiophen-3-yl)-2-morpholin-3-ylethanone
CID 116595850
1-(8-azabicyclo[3.2.1]octan-3-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-one
CID 116588403
1-(1-methylimidazol-2-yl)-3-morpholin-3-ylpropan-2-one
CID 116595774
1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one
CID 116595828
CID 131842856
CID 131842856
1-(2,5-difluorophenyl)-3-morpholin-3-ylpropan-2-one
CID 116595683
1-[6-methyl-4-(oxan-3-yloxy)-2-pyridinyl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 158295970
3-methyl-1-morpholin-3-ylbut-3-en-2-one
CID 116595710
1-(1-aminocyclobutyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-one
CID 116591347
1-[1-(aminomethyl)cyclohexyl]-3-(4-methyl-1,3-thiazol-2-yl)propan-2-one
CID 116614454

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one?
The IUPAC name of 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one (CID 116595810) is 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one.
What is the SMILES notation for 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one?
The canonical SMILES for 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one is Cc1csc(CC(=O)CC2COCCN2)n1.
What is the InChIKey of 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one?
The InChIKey is UOTLSHZJIIVLGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-8-7-16-11(13-8)5-10(14)4-9-6-15-3-2-12-9/h7,9,12H,2-6H2,1H3.
What are the key properties of 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one?
1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one has a molecular weight of 240.33 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one is sourced from PubChem (CID 116595810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).