5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one

C15H22N2O4 — CID 128978782

IUPAC5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one
SMILESCOCC1CN(C(=O)c2c[nH]c(=O)cc2C)CC(C)(C)O1
InChIInChI=1S/C15H22N2O4/c1-10-5-13(18)16-6-12(10)14(19)17-7-11(8-20-4)21-15(2,3)9-17/h5-6,11H,7-9H2,1-4H3,(H,16,18)
InChIKeyDFYLRLSYZQULIH-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.95
Rot. Bonds3

About 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one

5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one (PubChem CID 128978782) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one
PubChem CID128978782
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one
SMILESCOCC1CN(C(=O)c2c[nH]c(=O)cc2C)CC(C)(C)O1
InChIInChI=1S/C15H22N2O4/c1-10-5-13(18)16-6-12(10)14(19)17-7-11(8-20-4)21-15(2,3)9-17/h5-6,11H,7-9H2,1-4H3,(H,16,18)
InChIKeyDFYLRLSYZQULIH-UHFFFAOYSA-N
XLogP0.95
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one?
The IUPAC name of 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one (CID 128978782) is 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one.
What is the SMILES notation for 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one?
The canonical SMILES for 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one is COCC1CN(C(=O)c2c[nH]c(=O)cc2C)CC(C)(C)O1.
What is the InChIKey of 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one?
The InChIKey is DFYLRLSYZQULIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-10-5-13(18)16-6-12(10)14(19)17-7-11(8-20-4)21-15(2,3)9-17/h5-6,11H,7-9H2,1-4H3,(H,16,18).
What are the key properties of 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one?
5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one has a molecular weight of 294.35 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one is sourced from PubChem (CID 128978782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).