6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine

C13H21N3O3 — CID 114775371

IUPAC6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2noc(C3CC3)n2)O1
InChIInChI=1S/C13H21N3O3/c1-13(2)8-14-5-10(18-13)6-17-7-11-15-12(19-16-11)9-3-4-9/h9-10,14H,3-8H2,1-2H3
InChIKeyLYRICPHSMCLDLC-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.23
Rot. Bonds5

About 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine

6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine (PubChem CID 114775371) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine.

Molecular Properties

Compound Name6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine
PubChem CID114775371
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2noc(C3CC3)n2)O1
InChIInChI=1S/C13H21N3O3/c1-13(2)8-14-5-10(18-13)6-17-7-11-15-12(19-16-11)9-3-4-9/h9-10,14H,3-8H2,1-2H3
InChIKeyLYRICPHSMCLDLC-UHFFFAOYSA-N
XLogP1.23
TPSA69.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,2-dimethyl-6-[(5-methyl-1,2-oxazol-3-yl)methoxymethyl]morpholine
CID 114775307
6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775626
N-methyl-4-[3-(propoxymethyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 55202433
3-[(6,6-dimethylmorpholin-2-yl)methoxy]-N,N-dimethylpropan-1-amine
CID 114775638
2,2-dimethyl-6-(oxolan-3-ylmethoxymethyl)morpholine
CID 114775329
2-[2-[(6,6-dimethylmorpholin-2-yl)methoxymethyl]phenyl]acetic acid
CID 106940905
6-[(3-methoxyphenyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775645
2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine
CID 114775589
2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
CID 114775795
5-[(3S)-piperidin-3-yl]-3-(propoxymethyl)-1,2,4-oxadiazole
CID 104911775
6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine
CID 102856484
2,2-dimethyl-6-[(2-nitrophenyl)methoxymethyl]morpholine
CID 114775521

Frequently Asked Questions

What is the IUPAC name of 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine?
The IUPAC name of 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine (CID 114775371) is 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine.
What is the SMILES notation for 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine?
The canonical SMILES for 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine is CC1(C)CNCC(COCc2noc(C3CC3)n2)O1.
What is the InChIKey of 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine?
The InChIKey is LYRICPHSMCLDLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-13(2)8-14-5-10(18-13)6-17-7-11-15-12(19-16-11)9-3-4-9/h9-10,14H,3-8H2,1-2H3.
What are the key properties of 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine?
6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine has a molecular weight of 267.33 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine is sourced from PubChem (CID 114775371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).