5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one

C19H21N5O3 — CID 146272619

IUPAC5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
SMILESCc1ccc(-c2nocc2Cn2ncc(N3CCOC(C)C3)cc2=O)cn1
InChIInChI=1S/C19H21N5O3/c1-13-3-4-15(8-20-13)19-16(12-27-22-19)11-24-18(25)7-17(9-21-24)23-5-6-26-14(2)10-23/h3-4,7-9,12,14H,5-6,10-11H2,1-2H3
InChIKeyXUOBJBMRYSIJMB-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.88
Rot. Bonds4

About 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one

5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one (PubChem CID 146272619) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
PubChem CID146272619
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
SMILESCc1ccc(-c2nocc2Cn2ncc(N3CCOC(C)C3)cc2=O)cn1
InChIInChI=1S/C19H21N5O3/c1-13-3-4-15(8-20-13)19-16(12-27-22-19)11-24-18(25)7-17(9-21-24)23-5-6-26-14(2)10-23/h3-4,7-9,12,14H,5-6,10-11H2,1-2H3
InChIKeyXUOBJBMRYSIJMB-UHFFFAOYSA-N
XLogP1.88
TPSA86.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one with MolForge

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Related Compounds

2-[[3-(6-chloro-3-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-5-(2-methylmorpholin-4-yl)pyridazin-3-one
CID 146272718
2-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]-5-(6-oxa-3-azabicyclo[3.1.1]heptan-3-yl)pyridazin-3-one
CID 146272909
2-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]-5-(7-oxa-2-azaspiro[3.5]nonan-2-yl)pyridazin-3-one
CID 146273155
tert-butyl 2,6-dimethyl-4-[1-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]-6-oxopyridazin-4-yl]piperazine-1-carboxylate
CID 146273144
5-(8-fluoro-5-oxa-2-azaspiro[3.5]nonan-2-yl)-2-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
CID 146272765
5-[7-(difluoromethoxy)-5-oxa-2-azaspiro[3.4]octan-2-yl]-2-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
CID 146272626
(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine
CID 168795643
5-(1-cyclopropylpyrazol-4-yl)-2-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
CID 146273127
5-[3-(2,2-difluoroethoxy)azetidin-1-yl]-2-[[5-methyl-3-[6-(trifluoromethyl)-3-pyridinyl]-1,2-oxazol-4-yl]methyl]pyridazin-3-one
CID 146272775
2-[[3-(6-chloro-3-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-5-[(8R)-8-fluoro-5-oxa-2-azaspiro[3.5]nonan-2-yl]pyridazin-3-one
CID 146275225
2-[(2-chloro-3-pyridinyl)methyl]-5-pyrrolidin-1-ylpyridazin-3-one
CID 114395520
[5-(2-methylmorpholin-4-yl)-2-pyridinyl]methanamine
CID 115486800

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one?
The IUPAC name of 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one (CID 146272619) is 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one?
The canonical SMILES for 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one is Cc1ccc(-c2nocc2Cn2ncc(N3CCOC(C)C3)cc2=O)cn1.
What is the InChIKey of 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one?
The InChIKey is XUOBJBMRYSIJMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-13-3-4-15(8-20-13)19-16(12-27-22-19)11-24-18(25)7-17(9-21-24)23-5-6-26-14(2)10-23/h3-4,7-9,12,14H,5-6,10-11H2,1-2H3.
What are the key properties of 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one?
5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one has a molecular weight of 367.41 g/mol, XLogP of 1.88, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 146272619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).