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

C9H15N3O3 — CID 103222730

IUPAC5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one
SMILESNCCOc1cnn(CCCO)c(=O)c1
InChIInChI=1S/C9H15N3O3/c10-2-5-15-8-6-9(14)12(11-7-8)3-1-4-13/h6-7,13H,1-5,10H2
InChIKeyBYMWIGLIDYBYGE-UHFFFAOYSA-N
MW213.24 g/mol
LogP-1.04
Rot. Bonds6

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

5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one (PubChem CID 103222730) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one
PubChem CID103222730
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one
SMILESNCCOc1cnn(CCCO)c(=O)c1
InChIInChI=1S/C9H15N3O3/c10-2-5-15-8-6-9(14)12(11-7-8)3-1-4-13/h6-7,13H,1-5,10H2
InChIKeyBYMWIGLIDYBYGE-UHFFFAOYSA-N
XLogP-1.04
TPSA90.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
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-(3-Aminopropoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223299
5-(2-Aminoethoxy)-2-methylpyridazin-3-one
CID 84075911
5-(2-Aminoethoxy)-2-hexylpyridazin-3-one
CID 103222645
5-(2-Aminoethoxy)-2-(2-methylpropyl)pyridazin-3-one
CID 103222646
2-[4-(2-Aminoethoxy)-6-oxopyridazin-1-yl]acetonitrile
CID 103222651
5-(2-Aminoethoxy)-2-(2-hydroxyethyl)pyridazin-3-one
CID 103222659
5-(2-Aminoethoxy)-2-(5-hydroxypentyl)pyridazin-3-one
CID 103222668
5-(2-Aminoethoxy)-2-(4-methoxybutyl)pyridazin-3-one
CID 103222678
5-(2-Aminoethoxy)-2-pent-3-ynylpyridazin-3-one
CID 103222679
5-(2-Aminoethoxy)-2-[3-(dimethylamino)propyl]pyridazin-3-one
CID 103222680
5-(2-Aminoethoxy)-2-(3-methoxypropyl)pyridazin-3-one
CID 103222681

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one (CID 103222730) is 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one is NCCOc1cnn(CCCO)c(=O)c1.
What is the InChIKey of 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one?
The InChIKey is BYMWIGLIDYBYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c10-2-5-15-8-6-9(14)12(11-7-8)3-1-4-13/h6-7,13H,1-5,10H2.
What are the key properties of 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one has a molecular weight of 213.24 g/mol, XLogP of -1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-(3-hydroxypropyl)pyridazin-3-one is sourced from PubChem (CID 103222730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).