2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one

C12H19N3O3 — CID 10015131

IUPAC2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
SMILESCCCOc1nn(C)c(=O)cc1N1CCOCC1
InChIInChI=1S/C12H19N3O3/c1-3-6-18-12-10(9-11(16)14(2)13-12)15-4-7-17-8-5-15/h9H,3-8H2,1-2H3
InChIKeyYOZWJMDYDYEFOV-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.41
Rot. Bonds4

About 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one

2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one (PubChem CID 10015131) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one.

Molecular Properties

Compound Name2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
PubChem CID10015131
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
SMILESCCCOc1nn(C)c(=O)cc1N1CCOCC1
InChIInChI=1S/C12H19N3O3/c1-3-6-18-12-10(9-11(16)14(2)13-12)15-4-7-17-8-5-15/h9H,3-8H2,1-2H3
InChIKeyYOZWJMDYDYEFOV-UHFFFAOYSA-N
XLogP0.41
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-Methyl-5-(morpholin-4-yl)pyridazin-3(2H)-one
CID 12473911
2-(3-Methylbut-2-enyl)-5-morpholin-4-ylpyridazin-3-one
CID 72849993
3-butoxy-4-morpholin-4-yl-1H-pyridazin-6-one
CID 163451616
6-Methoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 9991237
5-Morpholin-4-yl-2-pentyl-6-propoxypyridazin-3-one
CID 9995485
2-Methyl-5-morpholin-4-yl-6-octoxypyridazin-3-one
CID 9996316
6-Ethoxy-2-methyl-5-piperidin-1-ylpyridazin-3-one
CID 10037168
6-Butoxy-2-ethyl-5-morpholin-4-ylpyridazin-3-one
CID 10039368
5-Morpholin-4-yl-6-propoxy-2-propylpyridazin-3-one
CID 10039369
6-Butoxy-2-methyl-5-piperidin-1-ylpyridazin-3-one
CID 10061409
6-Butoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 10061509
2-Cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one
CID 10063825

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The IUPAC name of 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one (CID 10015131) is 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one.
What is the SMILES notation for 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The canonical SMILES for 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one is CCCOc1nn(C)c(=O)cc1N1CCOCC1.
What is the InChIKey of 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The InChIKey is YOZWJMDYDYEFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-3-6-18-12-10(9-11(16)14(2)13-12)15-4-7-17-8-5-15/h9H,3-8H2,1-2H3.
What are the key properties of 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one has a molecular weight of 253.30 g/mol, XLogP of 0.41, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one is sourced from PubChem (CID 10015131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).