1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one

C23H20N4O3 — CID 980411

IUPAC1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one
SMILESO=c1nc(N2CCOCC2)ccn1-c1nc(-c2ccccc2)oc1-c1ccccc1
InChIInChI=1S/C23H20N4O3/c28-23-24-19(26-13-15-29-16-14-26)11-12-27(23)21-20(17-7-3-1-4-8-17)30-22(25-21)18-9-5-2-6-10-18/h1-12H,13-16H2
InChIKeyZZMFSARZRHZNDQ-UHFFFAOYSA-N
MW400.44 g/mol
LogP3.39
Rot. Bonds4

About 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one

1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one (PubChem CID 980411) has the molecular formula C23H20N4O3 and a molecular weight of 400.44 g/mol. Its IUPAC name is 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one.

Molecular Properties

Compound Name1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one
PubChem CID980411
Molecular FormulaC23H20N4O3
Molecular Weight400.44 g/mol
Exact Mass400.15
IUPAC Name1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one
SMILESO=c1nc(N2CCOCC2)ccn1-c1nc(-c2ccccc2)oc1-c1ccccc1
InChIInChI=1S/C23H20N4O3/c28-23-24-19(26-13-15-29-16-14-26)11-12-27(23)21-20(17-7-3-1-4-8-17)30-22(25-21)18-9-5-2-6-10-18/h1-12H,13-16H2
InChIKeyZZMFSARZRHZNDQ-UHFFFAOYSA-N
XLogP3.39
TPSA73.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.44
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-(furan-2-ylmethylamino)pyrimidin-2-one
CID 18558806
4-[4-(benzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine
CID 1110868
4-(2-phenyl-1,3-oxazol-5-yl)morpholine
CID 13179056
3-methyl-2-morpholin-4-yl-6-phenylpyrimidin-4-one
CID 155812528
4-(5-nitro-6-phenyl-2-pyridinyl)morpholine
CID 133407232
2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine
CID 44554800
3-morpholin-4-yl-5-phenyl-1H-pyridazin-6-one
CID 11680448
5-morpholin-4-yl-6-phenyl-2H-1,2,4-triazin-3-one
CID 11482308
5-(azepan-1-yl)-2-phenyl-[1,3]oxazolo[5,4-b]pyridine
CID 71256258
4-(4-morpholin-4-yl-6-phenylpyrimidin-2-yl)piperazine-1-carbaldehyde
CID 112935367
5-methyl-2,6-diphenyl-1,3-oxazin-4-one
CID 13028435
2-[4-(4-carboxy-5-phenyl-1,3-oxazol-2-yl)phenyl]-5-phenyl-1,3-oxazole-4-carboxylic acid
CID 71408646

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one?
The IUPAC name of 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one (CID 980411) is 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one.
What is the SMILES notation for 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one?
The canonical SMILES for 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one is O=c1nc(N2CCOCC2)ccn1-c1nc(-c2ccccc2)oc1-c1ccccc1.
What is the InChIKey of 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one?
The InChIKey is ZZMFSARZRHZNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3/c28-23-24-19(26-13-15-29-16-14-26)11-12-27(23)21-20(17-7-3-1-4-8-17)30-22(25-21)18-9-5-2-6-10-18/h1-12H,13-16H2.
What are the key properties of 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one?
1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one has a molecular weight of 400.44 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-diphenyl-1,3-oxazol-4-yl)-4-morpholin-4-ylpyrimidin-2-one is sourced from PubChem (CID 980411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).