5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one

C11H15BrN2O3 — CID 90408554

IUPAC5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one
SMILESO=c1c(N2CCOCC2)cc(Br)cn1CCO
InChIInChI=1S/C11H15BrN2O3/c12-9-7-10(13-2-5-17-6-3-13)11(16)14(8-9)1-4-15/h7-8,15H,1-6H2
InChIKeySUBJNGDQVDJWQL-UHFFFAOYSA-N
MW303.16 g/mol
LogP0.44
Rot. Bonds3

About 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one

5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one (PubChem CID 90408554) has the molecular formula C11H15BrN2O3 and a molecular weight of 303.16 g/mol. Its IUPAC name is 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one.

Molecular Properties

Compound Name5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one
PubChem CID90408554
Molecular FormulaC11H15BrN2O3
Molecular Weight303.16 g/mol
Exact Mass302.03
IUPAC Name5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one
SMILESO=c1c(N2CCOCC2)cc(Br)cn1CCO
InChIInChI=1S/C11H15BrN2O3/c12-9-7-10(13-2-5-17-6-3-13)11(16)14(8-9)1-4-15/h7-8,15H,1-6H2
InChIKeySUBJNGDQVDJWQL-UHFFFAOYSA-N
XLogP0.44
TPSA54.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-Hydroxyethyl)-5-morpholin-4-ylpyridin-2-one
CID 59843097
4-bromo-1-(2-morpholinoethyl)pyridin-2(1H)-one
CID 68734747
5-bromo-1-isopropyl-3-morpholinopyridin-2(1H)-one
CID 90408099
5-bromo-1-ethyl-3-morpholinopyridin-2(1H)-one
CID 90408118
(2S)-2-(5-bromo-3-morpholin-4-yl-2-oxo-1-pyridinyl)propanenitrile
CID 90408167
2-(5-Bromo-3-morpholin-4-yl-2-oxo-1-pyridinyl)propanenitrile
CID 90408170
2-(5-Bromo-3-morpholin-4-yl-2-oxo-1-pyridinyl)acetonitrile
CID 90408596
5-bromo-1-methyl-3-morpholinopyridin-2(1H)-one
CID 90408938
3-bromo-1-methyl-5-morpholinopyridin-2(1H)-one
CID 90409027
(2R)-2-(5-bromo-3-morpholin-4-yl-2-oxo-1-pyridinyl)propanenitrile
CID 90409154
2-(5-Bromo-3-morpholin-4-yl-2-oxo-1-pyridinyl)ethylcarbamic acid
CID 90409213
5-Bromo-3-morpholinopyridin-2-ol
CID 90409853

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one?
The IUPAC name of 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one (CID 90408554) is 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one.
What is the SMILES notation for 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one?
The canonical SMILES for 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one is O=c1c(N2CCOCC2)cc(Br)cn1CCO.
What is the InChIKey of 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one?
The InChIKey is SUBJNGDQVDJWQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O3/c12-9-7-10(13-2-5-17-6-3-13)11(16)14(8-9)1-4-15/h7-8,15H,1-6H2.
What are the key properties of 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one?
5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one has a molecular weight of 303.16 g/mol, XLogP of 0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-(2-hydroxyethyl)-3-morpholin-4-ylpyridin-2-one is sourced from PubChem (CID 90408554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).