5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one

C14H24N4O2 — CID 103218962

IUPAC5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
SMILESCCNc1cnn(CC2CN(C(C)C)CCO2)c(=O)c1
InChIInChI=1S/C14H24N4O2/c1-4-15-12-7-14(19)18(16-8-12)10-13-9-17(11(2)3)5-6-20-13/h7-8,11,13,15H,4-6,9-10H2,1-3H3
InChIKeyLXYFONSFNQUAFR-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.78
Rot. Bonds5

About 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one

5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one (PubChem CID 103218962) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
PubChem CID103218962
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one
SMILESCCNc1cnn(CC2CN(C(C)C)CCO2)c(=O)c1
InChIInChI=1S/C14H24N4O2/c1-4-15-12-7-14(19)18(16-8-12)10-13-9-17(11(2)3)5-6-20-13/h7-8,11,13,15H,4-6,9-10H2,1-3H3
InChIKeyLXYFONSFNQUAFR-UHFFFAOYSA-N
XLogP0.78
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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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
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
N-{1-[1-(2-Methoxyethyl)-6-oxo-1,6-dihydropyridazin-4-YL]piperidin-4-YL}-2-methylbutanamide
CID 91911848
2-Ethyl-N-{1-[1-(2-methoxyethyl)-6-oxo-1,6-dihydropyridazin-4-YL]piperidin-4-YL}butanamide
CID 91911849
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 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one?
The IUPAC name of 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one (CID 103218962) is 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one.
What is the SMILES notation for 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one?
The canonical SMILES for 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one is CCNc1cnn(CC2CN(C(C)C)CCO2)c(=O)c1.
What is the InChIKey of 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one?
The InChIKey is LXYFONSFNQUAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-4-15-12-7-14(19)18(16-8-12)10-13-9-17(11(2)3)5-6-20-13/h7-8,11,13,15H,4-6,9-10H2,1-3H3.
What are the key properties of 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one?
5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one has a molecular weight of 280.37 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-2-[(4-propan-2-ylmorpholin-2-yl)methyl]pyridazin-3-one is sourced from PubChem (CID 103218962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).