5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one

C12H18N4O4 — CID 103222745

IUPAC5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
SMILESNCCOc1cnn(CC(=O)N2CCOCC2)c(=O)c1
InChIInChI=1S/C12H18N4O4/c13-1-4-20-10-7-11(17)16(14-8-10)9-12(18)15-2-5-19-6-3-15/h7-8H,1-6,9,13H2
InChIKeyLKQYKGXNPZXMJJ-UHFFFAOYSA-N
MW282.30 g/mol
LogP-1.56
Rot. Bonds5

About 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one

5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one (PubChem CID 103222745) has the molecular formula C12H18N4O4 and a molecular weight of 282.30 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
PubChem CID103222745
Molecular FormulaC12H18N4O4
Molecular Weight282.30 g/mol
Exact Mass282.13
IUPAC Name5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
SMILESNCCOc1cnn(CC(=O)N2CCOCC2)c(=O)c1
InChIInChI=1S/C12H18N4O4/c13-1-4-20-10-7-11(17)16(14-8-10)9-12(18)15-2-5-19-6-3-15/h7-8H,1-6,9,13H2
InChIKeyLKQYKGXNPZXMJJ-UHFFFAOYSA-N
XLogP-1.56
TPSA99.68 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 5-1.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[2-aminoethyl(methyl)amino]-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
CID 103223399
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-tert-butylacetamide
CID 103222790
3-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide
CID 103222872
5-(2-aminoethoxy)-2-[(3,5-dimethylphenyl)methyl]pyridazin-3-one
CID 103222695
6-cyclopropyl-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
CID 122160609
4-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]butanenitrile
CID 103222795
5-methyl-2-(2-morpholin-4-yl-2-oxoethyl)-3-oxopyridazine-4-carboxylic acid
CID 175313059
5-(2-aminoethoxy)-2-[(5,5-dimethyloxolan-2-yl)methyl]pyridazin-3-one
CID 103222865
5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one
CID 97284720
5-morpholin-4-yl-2-(2-oxopropyl)pyridazin-3-one
CID 1479795
5-(2-aminoethoxy)-2-[(3-chlorophenyl)methyl]pyridazin-3-one
CID 103222750
1-(2-morpholin-4-yl-2-oxoethyl)quinoxalin-2-one
CID 8892399

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one (CID 103222745) is 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one is NCCOc1cnn(CC(=O)N2CCOCC2)c(=O)c1.
What is the InChIKey of 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The InChIKey is LKQYKGXNPZXMJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O4/c13-1-4-20-10-7-11(17)16(14-8-10)9-12(18)15-2-5-19-6-3-15/h7-8H,1-6,9,13H2.
What are the key properties of 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one has a molecular weight of 282.30 g/mol, XLogP of -1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one is sourced from PubChem (CID 103222745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).