5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one

C11H17N3O3 — CID 103222768

IUPAC5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one
SMILESNCCOc1cnn(CC2CCCO2)c(=O)c1
InChIInChI=1S/C11H17N3O3/c12-3-5-17-10-6-11(15)14(13-7-10)8-9-2-1-4-16-9/h6-7,9H,1-5,8,12H2
InChIKeyUUXWNWJHJXEOOL-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.24
Rot. Bonds5

About 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one

5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one (PubChem CID 103222768) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one
PubChem CID103222768
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one
SMILESNCCOc1cnn(CC2CCCO2)c(=O)c1
InChIInChI=1S/C11H17N3O3/c12-3-5-17-10-6-11(15)14(13-7-10)8-9-2-1-4-16-9/h6-7,9H,1-5,8,12H2
InChIKeyUUXWNWJHJXEOOL-UHFFFAOYSA-N
XLogP-0.24
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-Chloro-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 177774589
2-[2-(Oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
CID 62848753
5-Amino-2-[(5-methyloxolan-2-yl)methyl]pyridazin-3-one
CID 103218268
5-Amino-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 103218294
5-(Methylamino)-2-[(5-methyloxolan-2-yl)methyl]pyridazin-3-one
CID 103218552
5-(Methylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 103218578
5-(Ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 103219012
2-[(5-Methyloxolan-2-yl)methyl]-5-(propan-2-ylamino)pyridazin-3-one
CID 103219412
2-(Oxolan-2-ylmethyl)-5-(propan-2-ylamino)pyridazin-3-one
CID 103219451
2-[(5-Methyloxolan-2-yl)methyl]-5-(propylamino)pyridazin-3-one
CID 103220169
2-(Oxolan-2-ylmethyl)-5-(propylamino)pyridazin-3-one
CID 103220197
5-(Cyclobutylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 103220570

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one (CID 103222768) is 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one is NCCOc1cnn(CC2CCCO2)c(=O)c1.
What is the InChIKey of 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The InChIKey is UUXWNWJHJXEOOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c12-3-5-17-10-6-11(15)14(13-7-10)8-9-2-1-4-16-9/h6-7,9H,1-5,8,12H2.
What are the key properties of 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one has a molecular weight of 239.27 g/mol, XLogP of -0.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-(oxolan-2-ylmethyl)pyridazin-3-one is sourced from PubChem (CID 103222768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).