5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one

C9H15N3O3 — CID 103222798

IUPAC5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1ncc(OCCN)cc1=O
InChIInChI=1S/C9H15N3O3/c1-14-5-3-12-9(13)6-8(7-11-12)15-4-2-10/h6-7H,2-5,10H2,1H3
InChIKeyPYHRHXBNERKGRX-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.77
Rot. Bonds6

About 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one

5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one (PubChem CID 103222798) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one
PubChem CID103222798
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1ncc(OCCN)cc1=O
InChIInChI=1S/C9H15N3O3/c1-14-5-3-12-9(13)6-8(7-11-12)15-4-2-10/h6-7H,2-5,10H2,1H3
InChIKeyPYHRHXBNERKGRX-UHFFFAOYSA-N
XLogP-0.77
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-Aminoethoxy)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103222856
5-(2-Aminoethoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103222873
5-(2-Aminopropoxy)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103223073
5-(2-Aminopropoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223090
5-(3-Aminopropoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223299
2-[6-Oxo-1-(2,2,2-trifluoroethyl)pyridazin-4-yl]oxyacetamide
CID 162567664
2-(2-Ethoxyethyl)-5-hydroxypyridazin-3-one
CID 57059473
5-Hydroxy-2-(2-methoxyethyl)pyridazin-3-one
CID 57066440
2-(2-methoxy-ethyl)-5-methoxy-2H-pyridazin-3-one
CID 66865610
methyl N-[2-(1-tert-butyl-6-oxopyridazin-4-yl)oxyethyl]carbamate
CID 56683966
2-(3-Amino-2-ethoxypropyl)pyridazin-3-one
CID 63072355
5-(2-(dimethylamino)ethoxy)pyridazin-3(2H)-one
CID 71607368

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one (CID 103222798) is 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one is COCCn1ncc(OCCN)cc1=O.
What is the InChIKey of 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one?
The InChIKey is PYHRHXBNERKGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-14-5-3-12-9(13)6-8(7-11-12)15-4-2-10/h6-7H,2-5,10H2,1H3.
What are the key properties of 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one has a molecular weight of 213.24 g/mol, XLogP of -0.77, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-(2-methoxyethyl)pyridazin-3-one is sourced from PubChem (CID 103222798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).