2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one

C13H22N4O2 — CID 103220064

IUPAC2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(CCN2CCOCC2)c(=O)c1
InChIInChI=1S/C13H22N4O2/c1-2-3-14-12-10-13(18)17(15-11-12)5-4-16-6-8-19-9-7-16/h10-11,14H,2-9H2,1H3
InChIKeyWMWCGARHLPJNHN-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.40
Rot. Bonds6

About 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one

2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one (PubChem CID 103220064) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one
PubChem CID103220064
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(CCN2CCOCC2)c(=O)c1
InChIInChI=1S/C13H22N4O2/c1-2-3-14-12-10-13(18)17(15-11-12)5-4-16-6-8-19-9-7-16/h10-11,14H,2-9H2,1H3
InChIKeyWMWCGARHLPJNHN-UHFFFAOYSA-N
XLogP0.40
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-Methyl-5-(morpholin-4-yl)pyridazin-3(2H)-one
CID 12473911
2-methyl-5-(4-{[(1-methyl-2-morpholin-4-ylethyl)amino]methyl}piperidin-1-yl)pyridazin-3(2H)-one
CID 45229474
2-hydroxy-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}acetamide
CID 56898251
Propyl {2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}carbamate
CID 70730611
2-(3-Methylbut-2-enyl)-5-morpholin-4-ylpyridazin-3-one
CID 72849993
2-[4-[2-(2-aminoethyl)-4-morpholinyl]-6-oxo-1(6H)-pyridazinyl]-N-ethyl-N-methylacetamide
CID 56892429
N-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-pyrrolidinyl]methyl}-2-(4-morpholinyl)acetamide
CID 70715217
2-Ethoxy-N-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-YL)piperidin-4-YL]acetamide
CID 91924030
2-Ethoxy-N-[1-(1-ethyl-6-oxo-1,6-dihydropyridazin-4-YL)piperidin-4-YL]acetamide
CID 91924055
N-{1-[1-(2-Methoxyethyl)-6-oxo-1,6-dihydropyridazin-4-YL]piperidin-4-YL}-2-methylpropanamide
CID 91924078
2-Methoxy-N-{1-[1-(2-methoxyethyl)-6-oxo-1,6-dihydropyridazin-4-YL]piperidin-4-YL}acetamide
CID 91924087
N-{1-[1-(2-Methoxyethyl)-6-oxo-1,6-dihydropyridazin-4-YL]piperidin-4-YL}pentanamide
CID 91924088

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one?
The IUPAC name of 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one (CID 103220064) is 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one.
What is the SMILES notation for 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one?
The canonical SMILES for 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one is CCCNc1cnn(CCN2CCOCC2)c(=O)c1.
What is the InChIKey of 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one?
The InChIKey is WMWCGARHLPJNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-2-3-14-12-10-13(18)17(15-11-12)5-4-16-6-8-19-9-7-16/h10-11,14H,2-9H2,1H3.
What are the key properties of 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one?
2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one has a molecular weight of 266.34 g/mol, XLogP of 0.40, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethyl)-5-(propylamino)pyridazin-3-one is sourced from PubChem (CID 103220064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).