5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one

C12H17N5O2 — CID 103222662

IUPAC5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one
SMILESNCCOc1cnn(CCCn2ccnc2)c(=O)c1
InChIInChI=1S/C12H17N5O2/c13-2-7-19-11-8-12(18)17(15-9-11)5-1-4-16-6-3-14-10-16/h3,6,8-10H,1-2,4-5,7,13H2
InChIKeyAQDFXKJSJHQWDS-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.13
Rot. Bonds7

About 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one

5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one (PubChem CID 103222662) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one
PubChem CID103222662
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one
SMILESNCCOc1cnn(CCCn2ccnc2)c(=O)c1
InChIInChI=1S/C12H17N5O2/c13-2-7-19-11-8-12(18)17(15-9-11)5-1-4-16-6-3-14-10-16/h3,6,8-10H,1-2,4-5,7,13H2
InChIKeyAQDFXKJSJHQWDS-UHFFFAOYSA-N
XLogP-0.13
TPSA87.96 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-aminoethoxy)-2-propylpyridazin-3-one
CID 103222684
4-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]butanenitrile
CID 103222795
5-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]pentanenitrile
CID 103222821
5-(cyclopropylmethylamino)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one
CID 103221752
5-(3-aminopropoxy)-2-(3-ethylsulfanylpropyl)pyridazin-3-one
CID 103223312
5-(3-aminopropoxy)-2-(2-phenylsulfanylethyl)pyridazin-3-one
CID 103223238
5-(3-aminopropoxy)-2-[(3-chloro-4-pyridinyl)methyl]pyridazin-3-one
CID 103223127
1-[4-(4-chlorophenoxy)butyl]imidazole
CID 2843495
5-(2-aminoethoxy)-2-[(5,5-dimethyloxolan-2-yl)methyl]pyridazin-3-one
CID 103222865
3-imidazol-1-ylpropan-1-amine;hydrochloride
CID 19864194
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-tert-butylacetamide
CID 103222790
5-(2-aminoethoxy)-2-[(3-fluorophenyl)methyl]pyridazin-3-one
CID 103222846

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one (CID 103222662) is 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one is NCCOc1cnn(CCCn2ccnc2)c(=O)c1.
What is the InChIKey of 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one?
The InChIKey is AQDFXKJSJHQWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c13-2-7-19-11-8-12(18)17(15-9-11)5-1-4-16-6-3-14-10-16/h3,6,8-10H,1-2,4-5,7,13H2.
What are the key properties of 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one?
5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one has a molecular weight of 263.30 g/mol, XLogP of -0.13, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-(3-imidazol-1-ylpropyl)pyridazin-3-one is sourced from PubChem (CID 103222662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).