5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one

C12H20N4O3 — CID 103222654

IUPAC5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one
SMILESNCCOc1cnn(CCN2CCOCC2)c(=O)c1
InChIInChI=1S/C12H20N4O3/c13-1-6-19-11-9-12(17)16(14-10-11)3-2-15-4-7-18-8-5-15/h9-10H,1-8,13H2
InChIKeyYJRBUMANBSMTRL-UHFFFAOYSA-N
MW268.32 g/mol
LogP-1.09
Rot. Bonds6

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

5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one (PubChem CID 103222654) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one
PubChem CID103222654
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one
SMILESNCCOc1cnn(CCN2CCOCC2)c(=O)c1
InChIInChI=1S/C12H20N4O3/c13-1-6-19-11-9-12(17)16(14-10-11)3-2-15-4-7-18-8-5-15/h9-10H,1-8,13H2
InChIKeyYJRBUMANBSMTRL-UHFFFAOYSA-N
XLogP-1.09
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one (CID 103222654) is 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one is NCCOc1cnn(CCN2CCOCC2)c(=O)c1.
What is the InChIKey of 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one?
The InChIKey is YJRBUMANBSMTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c13-1-6-19-11-9-12(17)16(14-10-11)3-2-15-4-7-18-8-5-15/h9-10H,1-8,13H2.
What are the key properties of 5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(2-morpholin-4-ylethyl)pyridazin-3-one has a molecular weight of 268.32 g/mol, XLogP of -1.09, 6 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-ylethyl)pyridazin-3-one is sourced from PubChem (CID 103222654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).