2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one

C12H20N4O2 — CID 103218706

IUPAC2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one
SMILESCCN1CCOC(Cn2ncc(NC)cc2=O)C1
InChIInChI=1S/C12H20N4O2/c1-3-15-4-5-18-11(8-15)9-16-12(17)6-10(13-2)7-14-16/h6-7,11,13H,3-5,8-9H2,1-2H3
InChIKeyJMFDTMUYHLGCCH-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.01
Rot. Bonds4

About 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one

2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one (PubChem CID 103218706) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one
PubChem CID103218706
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one
SMILESCCN1CCOC(Cn2ncc(NC)cc2=O)C1
InChIInChI=1S/C12H20N4O2/c1-3-15-4-5-18-11(8-15)9-16-12(17)6-10(13-2)7-14-16/h6-7,11,13H,3-5,8-9H2,1-2H3
InChIKeyJMFDTMUYHLGCCH-UHFFFAOYSA-N
XLogP0.01
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)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

2-hydroxy-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}acetamide
CID 56898251
N-(tert-butyl)-N'-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}urea
CID 70717227
Propyl {2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}carbamate
CID 70730611
N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}-1-piperidinecarboxamide
CID 70756598
2-[2-[2-(Aminomethyl)morpholin-4-yl]-2-oxoethyl]-5-piperidin-1-ylpyridazin-3-one
CID 72893567
1-methyl-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}cyclopropanecarboxamide
CID 56885150
2-[4-[2-(2-aminoethyl)-4-morpholinyl]-6-oxo-1(6H)-pyridazinyl]-N-ethyl-N-methylacetamide
CID 56892429
N,N-dimethyl-N'-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}sulfamide
CID 70781144
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

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one?
The IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one (CID 103218706) is 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one.
What is the SMILES notation for 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one?
The canonical SMILES for 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one is CCN1CCOC(Cn2ncc(NC)cc2=O)C1.
What is the InChIKey of 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one?
The InChIKey is JMFDTMUYHLGCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-15-4-5-18-11(8-15)9-16-12(17)6-10(13-2)7-14-16/h6-7,11,13H,3-5,8-9H2,1-2H3.
What are the key properties of 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one?
2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one has a molecular weight of 252.32 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridazin-3-one is sourced from PubChem (CID 103218706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).