3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one

C12H18N2O3 — CID 20688193

IUPAC3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one
SMILESCc1c(O)c(=O)ccn1CCN1CCOCC1
InChIInChI=1S/C12H18N2O3/c1-10-12(16)11(15)2-3-14(10)5-4-13-6-8-17-9-7-13/h2-3,16H,4-9H2,1H3
InChIKeyXYYCYJNBZSTEPB-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.19
Rot. Bonds3

About 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one

3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one (PubChem CID 20688193) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one.

Molecular Properties

Compound Name3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one
PubChem CID20688193
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one
SMILESCc1c(O)c(=O)ccn1CCN1CCOCC1
InChIInChI=1S/C12H18N2O3/c1-10-12(16)11(15)2-3-14(10)5-4-13-6-8-17-9-7-13/h2-3,16H,4-9H2,1H3
InChIKeyXYYCYJNBZSTEPB-UHFFFAOYSA-N
XLogP0.19
TPSA54.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one?
The IUPAC name of 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one (CID 20688193) is 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one.
What is the SMILES notation for 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one?
The canonical SMILES for 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one is Cc1c(O)c(=O)ccn1CCN1CCOCC1.
What is the InChIKey of 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one?
The InChIKey is XYYCYJNBZSTEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-10-12(16)11(15)2-3-14(10)5-4-13-6-8-17-9-7-13/h2-3,16H,4-9H2,1H3.
What are the key properties of 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one?
3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one has a molecular weight of 238.29 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-1-(2-morpholin-4-ylethyl)pyridin-4-one is sourced from PubChem (CID 20688193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).