2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one

C13H20N4O2 — CID 107391429

IUPAC2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCC1CNC1
InChIInChI=1S/C13H20N4O2/c18-13-7-12(16-3-5-19-6-4-16)10-15-17(13)2-1-11-8-14-9-11/h7,10-11,14H,1-6,8-9H2
InChIKeyAXZRYBVXHWSOLP-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.31
Rot. Bonds4

About 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one

2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one (PubChem CID 107391429) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one.

Molecular Properties

Compound Name2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one
PubChem CID107391429
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCC1CNC1
InChIInChI=1S/C13H20N4O2/c18-13-7-12(16-3-5-19-6-4-16)10-15-17(13)2-1-11-8-14-9-11/h7,10-11,14H,1-6,8-9H2
InChIKeyAXZRYBVXHWSOLP-UHFFFAOYSA-N
XLogP-0.31
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-morpholin-4-yl-2-(2-piperidin-4-ylethyl)pyridazin-3-one
CID 105061198
5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one
CID 114395885
2-(3-aminopropyl)-5-morpholin-4-ylpyridazin-3-one
CID 114393701
5-morpholin-4-yl-2-(morpholin-2-ylmethyl)pyridazin-3-one
CID 114395891
2-[2-(cyclopropylmethylamino)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 114397506
5-morpholin-4-yl-2-(5-sulfanylpentyl)pyridazin-3-one
CID 114398871
2-(6-hydroxyhexyl)-5-morpholin-4-ylpyridazin-3-one
CID 107705269
2-[2-(ethylamino)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 114394647
5-morpholin-4-yl-2-(2-oxopropyl)pyridazin-3-one
CID 1479795
5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819931
5-(4-morpholin-4-yl-6-oxopyridazin-1-yl)pentanethioamide
CID 114395789
5-morpholin-4-yl-2-[3-(propylamino)propyl]pyridazin-3-one
CID 114394656

Frequently Asked Questions

What is the IUPAC name of 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The IUPAC name of 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one (CID 107391429) is 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one.
What is the SMILES notation for 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The canonical SMILES for 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one is O=c1cc(N2CCOCC2)cnn1CCC1CNC1.
What is the InChIKey of 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The InChIKey is AXZRYBVXHWSOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c18-13-7-12(16-3-5-19-6-4-16)10-15-17(13)2-1-11-8-14-9-11/h7,10-11,14H,1-6,8-9H2.
What are the key properties of 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one has a molecular weight of 264.33 g/mol, XLogP of -0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one is sourced from PubChem (CID 107391429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).