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

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Related Compounds

4,5-dimorpholin-4-yl-1H-pyridazin-6-one
CID 161394911
5-morpholin-4-yl-1H-pyridazin-6-one;hydrochloride
CID 175809424
4-(5-fluoro-6-morpholin-4-yl-1,3-dihydroisoindol-2-yl)-5-methyl-1H-pyridazin-6-one
CID 149056174
5-chloro-4-[4-(5-ethylpyrimidin-2-yl)piperazin-1-yl]-1H-pyridazin-6-one
CID 175651574
6-ethoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 10331817
3-methyl-2-(2-morpholin-4-ylethoxy)-4-propoxybenzaldehyde
CID 71420401
5-methyl-4-piperazin-1-yl-1H-pyridazin-6-one
CID 23018250
ethyl 2-amino-5-morpholin-4-ylpyridine-4-carboxylate
CID 114194649
4-(4-morpholin-4-yl-1,3-dihydroisoindol-2-yl)-5-(trifluoromethyl)-1H-pyridazin-6-one
CID 146218714
5-ethyl-6-methyl-4-morpholin-4-ylpyran-2-one
CID 121012939
methyl 2-morpholin-4-yl-5-[(4-propoxybenzoyl)amino]benzoate
CID 7328734
4-(4,5-difluoro-2-morpholin-4-ylphenyl)-1H-pyrazol-5-amine
CID 115112119

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).