3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one

C15H24N2O4 — CID 114778639

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one
SMILESCc1noc(C)c1CCC(=O)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C15H24N2O4/c1-10-13(11(2)21-16-10)5-6-14(19)17-7-12(8-18)20-15(3,4)9-17/h12,18H,5-9H2,1-4H3
InChIKeyGOGLMFKSXDGDDT-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.22
Rot. Bonds4

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one

3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one (PubChem CID 114778639) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one
PubChem CID114778639
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one
SMILESCc1noc(C)c1CCC(=O)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C15H24N2O4/c1-10-13(11(2)21-16-10)5-6-14(19)17-7-12(8-18)20-15(3,4)9-17/h12,18H,5-9H2,1-4H3
InChIKeyGOGLMFKSXDGDDT-UHFFFAOYSA-N
XLogP1.22
TPSA75.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[2-(hydroxymethyl)morpholin-4-yl]propan-1-one
CID 81209406
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]propan-1-one
CID 70754765
1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-pyridin-4-ylpropan-1-one
CID 114779032
2-[3-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-oxopropyl]sulfanylacetamide
CID 114778946
1-(7,7-dimethyl-6,8-dioxa-2-azaspiro[3.5]nonan-2-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one
CID 71789546
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(3-methyl-5-propan-2-yl-1,2-oxazol-4-yl)methanone
CID 114778454
5-[3-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-3-oxopropyl]-2,4-dimethyl-1H-pyrimidin-6-one
CID 137210435
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(3-methylpiperidin-1-yl)propan-1-one
CID 78791717
1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-(oxan-2-yl)propan-1-one
CID 114778648
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 102934323
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 134000213
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-hydroxy-4-(hydroxymethyl)azepan-1-yl]propan-1-one
CID 56908437

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one (CID 114778639) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one is Cc1noc(C)c1CCC(=O)N1CC(CO)OC(C)(C)C1.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one?
The InChIKey is GOGLMFKSXDGDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-10-13(11(2)21-16-10)5-6-14(19)17-7-12(8-18)20-15(3,4)9-17/h12,18H,5-9H2,1-4H3.
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one has a molecular weight of 296.37 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one is sourced from PubChem (CID 114778639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).