5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one

C13H20N2O4 — CID 82218215

IUPAC5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESCC(O)Cn1cc(O)c(=O)cc1CN1CCOCC1
InChIInChI=1S/C13H20N2O4/c1-10(16)7-15-9-13(18)12(17)6-11(15)8-14-2-4-19-5-3-14/h6,9-10,16,18H,2-5,7-8H2,1H3
InChIKeyZSRVJOWQPWLHTM-UHFFFAOYSA-N
MW268.31 g/mol
LogP-0.23
Rot. Bonds4

About 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one

5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one (PubChem CID 82218215) has the molecular formula C13H20N2O4 and a molecular weight of 268.31 g/mol. Its IUPAC name is 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one.

Molecular Properties

Compound Name5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one
PubChem CID82218215
Molecular FormulaC13H20N2O4
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESCC(O)Cn1cc(O)c(=O)cc1CN1CCOCC1
InChIInChI=1S/C13H20N2O4/c1-10(16)7-15-9-13(18)12(17)6-11(15)8-14-2-4-19-5-3-14/h6,9-10,16,18H,2-5,7-8H2,1H3
InChIKeyZSRVJOWQPWLHTM-UHFFFAOYSA-N
XLogP-0.23
TPSA74.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-hydroxy-2-(morpholin-4-ylmethyl)-1-prop-2-enylpyridin-4-one
CID 82218404
1-[4-(dimethylamino)butyl]-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94960996
1-(3-ethoxypropyl)-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 82218677
5-hydroxy-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-(2-methylpropyl)pyridin-4-one
CID 94959809
1-[2-(cyclohexen-1-yl)ethyl]-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94961024
5-hydroxy-1-(3-imidazol-1-ylpropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94961030
1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94960120
5-hydroxy-1-(2-hydroxyethyl)-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]pyridin-4-one
CID 82217995
5-hydroxy-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-propylpyridin-4-one
CID 82218115
5-hydroxy-1-(oxolan-2-ylmethyl)-2-(pyrrolidin-1-ylmethyl)pyridin-4-one
CID 82218489
1-[2-(dimethylamino)ethyl]-5-hydroxy-2-(piperidin-1-ylmethyl)pyridin-4-one
CID 82218906
5-hydroxy-2-[(4-methylpiperazin-1-yl)methyl]-1-pentylpyridin-4-one
CID 82218336

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one?
The IUPAC name of 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one (CID 82218215) is 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one.
What is the SMILES notation for 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one?
The canonical SMILES for 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one is CC(O)Cn1cc(O)c(=O)cc1CN1CCOCC1.
What is the InChIKey of 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one?
The InChIKey is ZSRVJOWQPWLHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4/c1-10(16)7-15-9-13(18)12(17)6-11(15)8-14-2-4-19-5-3-14/h6,9-10,16,18H,2-5,7-8H2,1H3.
What are the key properties of 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one?
5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one has a molecular weight of 268.31 g/mol, XLogP of -0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one is sourced from PubChem (CID 82218215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).