5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one

C13H19N3O3 — CID 55118439

IUPAC5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
SMILESCC1(C)CN(C(=O)Cn2cc(N)ccc2=O)CCO1
InChIInChI=1S/C13H19N3O3/c1-13(2)9-15(5-6-19-13)12(18)8-16-7-10(14)3-4-11(16)17/h3-4,7H,5-6,8-9,14H2,1-2H3
InChIKeyQJFDTNCMCXJXOX-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.07
Rot. Bonds2

About 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one

5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one (PubChem CID 55118439) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
PubChem CID55118439
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
SMILESCC1(C)CN(C(=O)Cn2cc(N)ccc2=O)CCO1
InChIInChI=1S/C13H19N3O3/c1-13(2)9-15(5-6-19-13)12(18)8-16-7-10(14)3-4-11(16)17/h3-4,7H,5-6,8-9,14H2,1-2H3
InChIKeyQJFDTNCMCXJXOX-UHFFFAOYSA-N
XLogP0.07
TPSA77.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one (CID 55118439) is 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one is CC1(C)CN(C(=O)Cn2cc(N)ccc2=O)CCO1.
What is the InChIKey of 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The InChIKey is QJFDTNCMCXJXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-13(2)9-15(5-6-19-13)12(18)8-16-7-10(14)3-4-11(16)17/h3-4,7H,5-6,8-9,14H2,1-2H3.
What are the key properties of 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one has a molecular weight of 265.31 g/mol, XLogP of 0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 55118439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).