3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one

C11H15N3O3 — CID 82992070

IUPAC3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
SMILESNc1cn(CC(=O)N2CCOCC2)ccc1=O
InChIInChI=1S/C11H15N3O3/c12-9-7-13(2-1-10(9)15)8-11(16)14-3-5-17-6-4-14/h1-2,7H,3-6,8,12H2
InChIKeyUWQGQQOVRGETJA-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.71
Rot. Bonds2

About 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one

3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one (PubChem CID 82992070) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one.

Molecular Properties

Compound Name3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
PubChem CID82992070
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
SMILESNc1cn(CC(=O)N2CCOCC2)ccc1=O
InChIInChI=1S/C11H15N3O3/c12-9-7-13(2-1-10(9)15)8-11(16)14-3-5-17-6-4-14/h1-2,7H,3-6,8,12H2
InChIKeyUWQGQQOVRGETJA-UHFFFAOYSA-N
XLogP-0.71
TPSA77.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The IUPAC name of 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one (CID 82992070) is 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one.
What is the SMILES notation for 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The canonical SMILES for 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one is Nc1cn(CC(=O)N2CCOCC2)ccc1=O.
What is the InChIKey of 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The InChIKey is UWQGQQOVRGETJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c12-9-7-13(2-1-10(9)15)8-11(16)14-3-5-17-6-4-14/h1-2,7H,3-6,8,12H2.
What are the key properties of 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one has a molecular weight of 237.26 g/mol, XLogP of -0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one is sourced from PubChem (CID 82992070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).