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

C15H25N3O3 — CID 10085879

IUPAC2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
SMILESCCCCn1nc(OCCC)c(N2CCOCC2)cc1=O
InChIInChI=1S/C15H25N3O3/c1-3-5-6-18-14(19)12-13(15(16-18)21-9-4-2)17-7-10-20-11-8-17/h12H,3-11H2,1-2H3
InChIKeyPZOFIKDMIDCNDX-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.67
Rot. Bonds7

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

2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one (PubChem CID 10085879) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one.

Molecular Properties

Compound Name2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
PubChem CID10085879
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
SMILESCCCCn1nc(OCCC)c(N2CCOCC2)cc1=O
InChIInChI=1S/C15H25N3O3/c1-3-5-6-18-14(19)12-13(15(16-18)21-9-4-2)17-7-10-20-11-8-17/h12H,3-11H2,1-2H3
InChIKeyPZOFIKDMIDCNDX-UHFFFAOYSA-N
XLogP1.67
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

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-propoxypyridazin-3-one
CID 10015131
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
6-Ethoxy-2-methyl-5-pyrrolidin-1-ylpyridazin-3-one
CID 10082326

Frequently Asked Questions

What is the IUPAC name of 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The IUPAC name of 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one (CID 10085879) is 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one.
What is the SMILES notation for 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The canonical SMILES for 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one is CCCCn1nc(OCCC)c(N2CCOCC2)cc1=O.
What is the InChIKey of 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
The InChIKey is PZOFIKDMIDCNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-3-5-6-18-14(19)12-13(15(16-18)21-9-4-2)17-7-10-20-11-8-17/h12H,3-11H2,1-2H3.
What are the key properties of 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one?
2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one has a molecular weight of 295.38 g/mol, XLogP of 1.67, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one is sourced from PubChem (CID 10085879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).