5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one

C13H22N4O3 — CID 103222844

IUPAC5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
SMILESCCN1CCOC(Cn2ncc(OCCN)cc2=O)C1
InChIInChI=1S/C13H22N4O3/c1-2-16-4-6-20-12(9-16)10-17-13(18)7-11(8-15-17)19-5-3-14/h7-8,12H,2-6,9-10,14H2,1H3
InChIKeyBXQUPMUYCFXPDX-UHFFFAOYSA-N
MW282.34 g/mol
LogP-0.70
Rot. Bonds6

About 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one

5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one (PubChem CID 103222844) has the molecular formula C13H22N4O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
PubChem CID103222844
Molecular FormulaC13H22N4O3
Molecular Weight282.34 g/mol
Exact Mass282.17
IUPAC Name5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
SMILESCCN1CCOC(Cn2ncc(OCCN)cc2=O)C1
InChIInChI=1S/C13H22N4O3/c1-2-16-4-6-20-12(9-16)10-17-13(18)7-11(8-15-17)19-5-3-14/h7-8,12H,2-6,9-10,14H2,1H3
InChIKeyBXQUPMUYCFXPDX-UHFFFAOYSA-N
XLogP-0.70
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[2-(2-Aminoethyl)morpholin-4-yl]-2-(2-ethoxyethyl)pyridazin-3-one
CID 56881771
2-(Morpholin-2-ylmethyl)pyridazin-3-one
CID 64533452
5-Amino-2-[(4-methylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103218371
5-Amino-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103218382
5-(Methylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103218545
2-[(4-Ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one
CID 103218706
5-(Ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103218962
5-(Ethylamino)-2-[(4-methylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103219133
5-(Ethylamino)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103219147
5-(Propan-2-ylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103219403
2-[(4-Methylmorpholin-2-yl)methyl]-5-(propan-2-ylamino)pyridazin-3-one
CID 103219538
2-[(4-Ethylmorpholin-2-yl)methyl]-5-(propan-2-ylamino)pyridazin-3-one
CID 103219548

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one (CID 103222844) is 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one is CCN1CCOC(Cn2ncc(OCCN)cc2=O)C1.
What is the InChIKey of 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one?
The InChIKey is BXQUPMUYCFXPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O3/c1-2-16-4-6-20-12(9-16)10-17-13(18)7-11(8-15-17)19-5-3-14/h7-8,12H,2-6,9-10,14H2,1H3.
What are the key properties of 5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one?
5-(2-aminoethoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one has a molecular weight of 282.34 g/mol, XLogP of -0.70, 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-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one is sourced from PubChem (CID 103222844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).