4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one

C11H17N3O3 — CID 131856588

IUPAC4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one
SMILESCCCOc1c(N2CCOCC2)cn[nH]c1=O
InChIInChI=1S/C11H17N3O3/c1-2-5-17-10-9(8-12-13-11(10)15)14-3-6-16-7-4-14/h8H,2-7H2,1H3,(H,13,15)
InChIKeyIRWZEMUBUJLZNQ-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.40
Rot. Bonds4

About 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one

4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one (PubChem CID 131856588) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one
PubChem CID131856588
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one
SMILESCCCOc1c(N2CCOCC2)cn[nH]c1=O
InChIInChI=1S/C11H17N3O3/c1-2-5-17-10-9(8-12-13-11(10)15)14-3-6-16-7-4-14/h8H,2-7H2,1H3,(H,13,15)
InChIKeyIRWZEMUBUJLZNQ-UHFFFAOYSA-N
XLogP0.40
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one?
The IUPAC name of 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one (CID 131856588) is 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one.
What is the SMILES notation for 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one?
The canonical SMILES for 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one is CCCOc1c(N2CCOCC2)cn[nH]c1=O.
What is the InChIKey of 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one?
The InChIKey is IRWZEMUBUJLZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-2-5-17-10-9(8-12-13-11(10)15)14-3-6-16-7-4-14/h8H,2-7H2,1H3,(H,13,15).
What are the key properties of 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one?
4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one has a molecular weight of 239.27 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-5-propoxy-1H-pyridazin-6-one is sourced from PubChem (CID 131856588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).