5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one

C13H20N4O2 — CID 102819931

IUPAC5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1C[C@H]1CCCN1
InChIInChI=1S/C13H20N4O2/c18-13-8-12(16-4-6-19-7-5-16)9-15-17(13)10-11-2-1-3-14-11/h8-9,11,14H,1-7,10H2/t11-/m1/s1
InChIKeyRROQUUITWVMJEG-LLVKDONJSA-N
MW264.33 g/mol
LogP-0.17
Rot. Bonds3

About 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one

5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one (PubChem CID 102819931) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
PubChem CID102819931
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1C[C@H]1CCCN1
InChIInChI=1S/C13H20N4O2/c18-13-8-12(16-4-6-19-7-5-16)9-15-17(13)10-11-2-1-3-14-11/h8-9,11,14H,1-7,10H2/t11-/m1/s1
InChIKeyRROQUUITWVMJEG-LLVKDONJSA-N
XLogP-0.17
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-pyrrolidin-1-yl-2-(pyrrolidin-2-ylmethyl)pyridazin-3-one
CID 114395863
5-morpholin-4-yl-2-(piperidin-4-ylmethyl)pyridazin-3-one
CID 114395885
5-(3-methoxypyrrolidin-1-yl)-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819951
5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 106548752
2-(2-piperidin-2-ylethyl)-5-pyrrolidin-1-ylpyridazin-3-one
CID 114395871
5-morpholin-4-yl-2-(morpholin-2-ylmethyl)pyridazin-3-one
CID 114395891
5-morpholin-4-yl-2-(2-piperidin-4-ylethyl)pyridazin-3-one
CID 105061198
2-[2-(azetidin-3-yl)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 107391429
2-(3-aminopropyl)-5-morpholin-4-ylpyridazin-3-one
CID 114393701
2-[2-(cyclopropylmethylamino)ethyl]-5-morpholin-4-ylpyridazin-3-one
CID 114397506
5-morpholin-4-yl-2-(2-oxopropyl)pyridazin-3-one
CID 1479795
5-morpholin-4-yl-2-(5-sulfanylpentyl)pyridazin-3-one
CID 114398871

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The IUPAC name of 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one (CID 102819931) is 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The canonical SMILES for 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one is O=c1cc(N2CCOCC2)cnn1C[C@H]1CCCN1.
What is the InChIKey of 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The InChIKey is RROQUUITWVMJEG-LLVKDONJSA-N. The full InChI is InChI=1S/C13H20N4O2/c18-13-8-12(16-4-6-19-7-5-16)9-15-17(13)10-11-2-1-3-14-11/h8-9,11,14H,1-7,10H2/t11-/m1/s1.
What are the key properties of 5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one has a molecular weight of 264.33 g/mol, XLogP of -0.17, 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-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 102819931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).