4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one

C20H20N4O5 — CID 136521699

IUPAC4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one
SMILESCc1cc(O)cc(=O)n1CC(=O)N1CCOCC1c1noc(-c2ccccc2)n1
InChIInChI=1S/C20H20N4O5/c1-13-9-15(25)10-17(26)24(13)11-18(27)23-7-8-28-12-16(23)19-21-20(29-22-19)14-5-3-2-4-6-14/h2-6,9-10,16,25H,7-8,11-12H2,1H3
InChIKeyCULBJBOZUHEAIL-UHFFFAOYSA-N
MW396.40 g/mol
LogP1.51
Rot. Bonds4

About 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one

4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one (PubChem CID 136521699) has the molecular formula C20H20N4O5 and a molecular weight of 396.40 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one
PubChem CID136521699
Molecular FormulaC20H20N4O5
Molecular Weight396.40 g/mol
Exact Mass396.14
IUPAC Name4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one
SMILESCc1cc(O)cc(=O)n1CC(=O)N1CCOCC1c1noc(-c2ccccc2)n1
InChIInChI=1S/C20H20N4O5/c1-13-9-15(25)10-17(26)24(13)11-18(27)23-7-8-28-12-16(23)19-21-20(29-22-19)14-5-3-2-4-6-14/h2-6,9-10,16,25H,7-8,11-12H2,1H3
InChIKeyCULBJBOZUHEAIL-UHFFFAOYSA-N
XLogP1.51
TPSA110.69 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.40
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one (CID 136521699) is 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one is Cc1cc(O)cc(=O)n1CC(=O)N1CCOCC1c1noc(-c2ccccc2)n1.
What is the InChIKey of 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one?
The InChIKey is CULBJBOZUHEAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O5/c1-13-9-15(25)10-17(26)24(13)11-18(27)23-7-8-28-12-16(23)19-21-20(29-22-19)14-5-3-2-4-6-14/h2-6,9-10,16,25H,7-8,11-12H2,1H3.
What are the key properties of 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one?
4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one has a molecular weight of 396.40 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one is sourced from PubChem (CID 136521699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).