5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one

C11H16N4O3 — CID 103218556

IUPAC5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
SMILESCNc1cnn(CC(=O)N2CCOCC2)c(=O)c1
InChIInChI=1S/C11H16N4O3/c1-12-9-6-10(16)15(13-7-9)8-11(17)14-2-4-18-5-3-14/h6-7,12H,2-5,8H2,1H3
InChIKeyAZTBPFXOEGNZIP-UHFFFAOYSA-N
MW252.27 g/mol
LogP-0.86
Rot. Bonds3

About 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one

5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one (PubChem CID 103218556) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
PubChem CID103218556
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
SMILESCNc1cnn(CC(=O)N2CCOCC2)c(=O)c1
InChIInChI=1S/C11H16N4O3/c1-12-9-6-10(16)15(13-7-9)8-11(17)14-2-4-18-5-3-14/h6-7,12H,2-5,8H2,1H3
InChIKeyAZTBPFXOEGNZIP-UHFFFAOYSA-N
XLogP-0.86
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[2-(Aminomethyl)morpholin-4-yl]-2-oxoethyl]-5-piperidin-1-ylpyridazin-3-one
CID 72893567
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
3-fluoro-5-morpholin-4-yl-4-(prop-2-enylamino)-1H-pyridazin-6-one
CID 44221606
5-(2-Aminoethylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103221290
5-[2-Aminoethyl(methyl)amino]-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223513
5-[2-(Methylamino)ethylamino]-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223724
2-(3-Amino-1,1,1-trifluoropropan-2-yl)-5-morpholin-4-ylpyridazin-3-one
CID 114393531
2-(3-Amino-1,1,1-trifluoropropan-2-yl)-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
CID 114393556
Ethyl 2-fluoro-2-[4-(4-methylpiperazin-1-yl)-6-oxopyridazin-1-yl]acetate
CID 114393937
5-Morpholin-4-yl-2-[2-(2,2,2-trifluoroethylamino)ethyl]pyridazin-3-one
CID 114397510
5-[2-Methoxyethyl(methyl)amino]-2-[2-(2,2,2-trifluoroethylamino)ethyl]pyridazin-3-one
CID 114397569

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The IUPAC name of 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one (CID 103218556) is 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one.
What is the SMILES notation for 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The canonical SMILES for 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one is CNc1cnn(CC(=O)N2CCOCC2)c(=O)c1.
What is the InChIKey of 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
The InChIKey is AZTBPFXOEGNZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-12-9-6-10(16)15(13-7-9)8-11(17)14-2-4-18-5-3-14/h6-7,12H,2-5,8H2,1H3.
What are the key properties of 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one?
5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one has a molecular weight of 252.27 g/mol, XLogP of -0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one is sourced from PubChem (CID 103218556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).