1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one

C13H20N2O3 — CID 82217519

IUPAC1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESCCn1c(C)cc(=O)c(O)c1CN1CCOCC1
InChIInChI=1S/C13H20N2O3/c1-3-15-10(2)8-12(16)13(17)11(15)9-14-4-6-18-7-5-14/h8,17H,3-7,9H2,1-2H3
InChIKeyOMUWKKFMOVKSEV-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.71
Rot. Bonds3

About 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one

1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one (PubChem CID 82217519) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one.

Molecular Properties

Compound Name1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one
PubChem CID82217519
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESCCn1c(C)cc(=O)c(O)c1CN1CCOCC1
InChIInChI=1S/C13H20N2O3/c1-3-15-10(2)8-12(16)13(17)11(15)9-14-4-6-18-7-5-14/h8,17H,3-7,9H2,1-2H3
InChIKeyOMUWKKFMOVKSEV-UHFFFAOYSA-N
XLogP0.71
TPSA54.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one?
The IUPAC name of 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one (CID 82217519) is 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one.
What is the SMILES notation for 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one?
The canonical SMILES for 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one is CCn1c(C)cc(=O)c(O)c1CN1CCOCC1.
What is the InChIKey of 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one?
The InChIKey is OMUWKKFMOVKSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-3-15-10(2)8-12(16)13(17)11(15)9-14-4-6-18-7-5-14/h8,17H,3-7,9H2,1-2H3.
What are the key properties of 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one?
1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one has a molecular weight of 252.31 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-hydroxy-6-methyl-2-(morpholin-4-ylmethyl)pyridin-4-one is sourced from PubChem (CID 82217519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).