4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine

C14H23N3O3 — CID 128977458

IUPAC4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
SMILESCCOc1cc(N2CC(COC)OC(C)(C)C2)ncn1
InChIInChI=1S/C14H23N3O3/c1-5-19-13-6-12(15-10-16-13)17-7-11(8-18-4)20-14(2,3)9-17/h6,10-11H,5,7-9H2,1-4H3
InChIKeyLOIPBMHLLIZHQH-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.51
Rot. Bonds5

About 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine

4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine (PubChem CID 128977458) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine.

Molecular Properties

Compound Name4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
PubChem CID128977458
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
SMILESCCOc1cc(N2CC(COC)OC(C)(C)C2)ncn1
InChIInChI=1S/C14H23N3O3/c1-5-19-13-6-12(15-10-16-13)17-7-11(8-18-4)20-14(2,3)9-17/h6,10-11H,5,7-9H2,1-4H3
InChIKeyLOIPBMHLLIZHQH-UHFFFAOYSA-N
XLogP1.51
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-(bromomethyl)-2,2-dimethyl-4-(6-propoxypyrimidin-4-yl)morpholine
CID 114780964
4-(6,7-difluoroquinoxalin-2-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 128977443
(6S)-4-(6,7-difluoroquinoxalin-2-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129484949
(6S)-4-(5-chloropyrimidin-2-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129484815
6-(methoxymethyl)-2,2-dimethyl-4-(tetrazolo[1,5-b]pyridazin-6-yl)morpholine
CID 128971158
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(tetrazolo[1,5-b]pyridazin-6-yl)morpholine
CID 129350244
6-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide
CID 128977424
4-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]benzonitrile
CID 128977436
[4-(6-methoxy-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methanamine
CID 114782322
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(1,6-naphthyridin-4-yl)morpholine
CID 129482266
1-(6-ethoxypyrimidin-4-yl)-N-methylpiperidin-4-amine;hydrochloride
CID 66569687
(6S)-4-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129345524

Frequently Asked Questions

What is the IUPAC name of 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The IUPAC name of 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine (CID 128977458) is 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine.
What is the SMILES notation for 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The canonical SMILES for 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine is CCOc1cc(N2CC(COC)OC(C)(C)C2)ncn1.
What is the InChIKey of 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The InChIKey is LOIPBMHLLIZHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-5-19-13-6-12(15-10-16-13)17-7-11(8-18-4)20-14(2,3)9-17/h6,10-11H,5,7-9H2,1-4H3.
What are the key properties of 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine has a molecular weight of 281.36 g/mol, XLogP of 1.51, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-ethoxypyrimidin-4-yl)-6-(methoxymethyl)-2,2-dimethylmorpholine is sourced from PubChem (CID 128977458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).