3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one

C14H22N2O4 — CID 139633094

IUPAC3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(OCC(O)CN2CCOCC2)c(C)[nH]1
InChIInChI=1S/C14H22N2O4/c1-10-7-13(18)14(11(2)15-10)20-9-12(17)8-16-3-5-19-6-4-16/h7,12,17H,3-6,8-9H2,1-2H3,(H,15,18)
InChIKeyFIFFAYFKDPIASI-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.06
Rot. Bonds5

About 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one

3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one (PubChem CID 139633094) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one.

Molecular Properties

Compound Name3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one
PubChem CID139633094
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC Name3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(OCC(O)CN2CCOCC2)c(C)[nH]1
InChIInChI=1S/C14H22N2O4/c1-10-7-13(18)14(11(2)15-10)20-9-12(17)8-16-3-5-19-6-4-16/h7,12,17H,3-6,8-9H2,1-2H3,(H,15,18)
InChIKeyFIFFAYFKDPIASI-UHFFFAOYSA-N
XLogP0.06
TPSA74.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one with MolForge

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Related Compounds

1-morpholin-4-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol;hydrochloride
CID 11971912
1-morpholin-4-yl-3-(2,4,6-tribromophenoxy)propan-2-ol
CID 660609
(2S)-1-(3,4-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 692870
ethane;1-(4-methylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 144771734
1-morpholin-4-yl-3-(3-propan-2-ylphenoxy)propan-2-ol
CID 110877512
methyl 4-[(2S)-2-hydroxy-3-morpholin-4-ylpropoxy]benzoate
CID 754353
(2R)-1-(3-fluoro-4-methylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 99838743
1-(2,3-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 16798644
4-(2-hydroxy-3-morpholin-4-ylpropoxy)benzonitrile
CID 3746908
[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate
CID 71177850
1-(3-methoxyphenoxy)-3-morpholin-4-ylpropan-2-ol;hydrochloride
CID 2770236
1-[4-[(2R)-2-hydroxy-3-morpholin-4-ylpropoxy]phenyl]propan-1-one
CID 977024

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one?
The IUPAC name of 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one (CID 139633094) is 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one.
What is the SMILES notation for 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one?
The canonical SMILES for 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one is Cc1cc(=O)c(OCC(O)CN2CCOCC2)c(C)[nH]1.
What is the InChIKey of 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one?
The InChIKey is FIFFAYFKDPIASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-10-7-13(18)14(11(2)15-10)20-9-12(17)8-16-3-5-19-6-4-16/h7,12,17H,3-6,8-9H2,1-2H3,(H,15,18).
What are the key properties of 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one?
3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one has a molecular weight of 282.34 g/mol, XLogP of 0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxy-3-morpholin-4-ylpropoxy)-2,6-dimethyl-1H-pyridin-4-one is sourced from PubChem (CID 139633094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).