6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one

C10H17N3O3 — CID 105062195

IUPAC6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one
SMILESCOCCNCCn1nc(OC)ccc1=O
InChIInChI=1S/C10H17N3O3/c1-15-8-6-11-5-7-13-10(14)4-3-9(12-13)16-2/h3-4,11H,5-8H2,1-2H3
InChIKeyQDCQMJKIDXVWNE-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.51
Rot. Bonds7

About 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one

6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one (PubChem CID 105062195) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one.

Molecular Properties

Compound Name6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one
PubChem CID105062195
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one
SMILESCOCCNCCn1nc(OC)ccc1=O
InChIInChI=1S/C10H17N3O3/c1-15-8-6-11-5-7-13-10(14)4-3-9(12-13)16-2/h3-4,11H,5-8H2,1-2H3
InChIKeyQDCQMJKIDXVWNE-UHFFFAOYSA-N
XLogP-0.51
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-Methoxy-2-[2-(2,2,2-trifluoroethylamino)ethyl]pyridazin-3-one
CID 113675831
Trimethyl-[2-[6-oxo-3-[2-(trimethylazaniumyl)ethoxy]pyridazin-1-yl]ethyl]azanium
CID 3380577
3(2H)-Pyridazinone, 6-[2-(diethylamino)ethoxy]-2-methyl-
CID 12015112
6-[2-(Trimethylamino)ethoxy]-2-[2-(trimethylamino)ethyl]-2-hydropyridazin-3-on e, iodide, iodide
CID 18528221
2-[2-(2-Butoxyethylamino)ethyl]pyridazin-3-one
CID 55126781
2-[2-(1-Methoxypropan-2-ylamino)ethyl]pyridazin-3-one
CID 62848751
2-[2-(2-Methoxyethylamino)ethyl]pyridazin-3-one
CID 62849093
2-[2-(2-Ethoxyethylamino)ethyl]pyridazin-3-one
CID 62850693
2-[2-(2-Methoxyethylamino)ethyl]-6-methylpyridazin-3-one
CID 62924969
2-[2-(1-Methoxypropan-2-ylamino)ethyl]-6-methylpyridazin-3-one
CID 62924970
2-[2-(2-Ethoxyethylamino)ethyl]-6-methylpyridazin-3-one
CID 62926707
2-[2-(2-Aminoethoxy)ethyl]-6-methoxypyridazin-3-one
CID 103482444

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one?
The IUPAC name of 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one (CID 105062195) is 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one.
What is the SMILES notation for 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one?
The canonical SMILES for 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one is COCCNCCn1nc(OC)ccc1=O.
What is the InChIKey of 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one?
The InChIKey is QDCQMJKIDXVWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-15-8-6-11-5-7-13-10(14)4-3-9(12-13)16-2/h3-4,11H,5-8H2,1-2H3.
What are the key properties of 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one?
6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one has a molecular weight of 227.26 g/mol, XLogP of -0.51, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-[2-(2-methoxyethylamino)ethyl]pyridazin-3-one is sourced from PubChem (CID 105062195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).