5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one

C14H22N4O2 — CID 114395885

IUPAC5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CC1CCNCC1
InChIInChI=1S/C14H22N4O2/c19-14-9-13(17-5-7-20-8-6-17)10-16-18(14)11-12-1-3-15-4-2-12/h9-10,12,15H,1-8,11H2
InChIKeyICXILVRYOHKBNU-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.08
Rot. Bonds3

About 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one

5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one (PubChem CID 114395885) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one
PubChem CID114395885
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CC1CCNCC1
InChIInChI=1S/C14H22N4O2/c19-14-9-13(17-5-7-20-8-6-17)10-16-18(14)11-12-1-3-15-4-2-12/h9-10,12,15H,1-8,11H2
InChIKeyICXILVRYOHKBNU-UHFFFAOYSA-N
XLogP0.08
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.08
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-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819931
5-pyrrolidin-1-yl-2-(pyrrolidin-3-ylmethyl)pyridazin-3-one;hydrochloride
CID 154899944
5-morpholin-4-yl-2-(morpholin-2-ylmethyl)pyridazin-3-one
CID 114395891
2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 107391429
5-(4-methoxypiperidin-1-yl)-2-(pyrrolidin-3-ylmethyl)pyridazin-3-one
CID 114395969
2-[2-(cyclopropylmethylamino)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 114397506
2-(3-aminopropyl)-5-morpholin-4-ylpyridazin-3-one
CID 114393701
5-morpholin-4-yl-2-(2-oxopropyl)pyridazin-3-one
CID 1479795
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

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one?
The IUPAC name of 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one (CID 114395885) is 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one.
What is the SMILES notation for 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one?
The canonical SMILES for 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one is O=c1cc(N2CCOCC2)cnn1CC1CCNCC1.
What is the InChIKey of 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one?
The InChIKey is ICXILVRYOHKBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c19-14-9-13(17-5-7-20-8-6-17)10-16-18(14)11-12-1-3-15-4-2-12/h9-10,12,15H,1-8,11H2.
What are the key properties of 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one?
5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one has a molecular weight of 278.36 g/mol, XLogP of 0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one is sourced from PubChem (CID 114395885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).