2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine

C13H27NO3 — CID 114775589

IUPAC2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine
SMILESCC(C)(C)OCCOCC1CNCC(C)(C)O1
InChIInChI=1S/C13H27NO3/c1-12(2,3)16-7-6-15-9-11-8-14-10-13(4,5)17-11/h11,14H,6-10H2,1-5H3
InChIKeyRHYNDAZUZDVFSA-UHFFFAOYSA-N
MW245.36 g/mol
LogP1.59
Rot. Bonds5

About 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine

2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine (PubChem CID 114775589) has the molecular formula C13H27NO3 and a molecular weight of 245.36 g/mol. Its IUPAC name is 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine.

Molecular Properties

Compound Name2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine
PubChem CID114775589
Molecular FormulaC13H27NO3
Molecular Weight245.36 g/mol
Exact Mass245.20
IUPAC Name2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine
SMILESCC(C)(C)OCCOCC1CNCC(C)(C)O1
InChIInChI=1S/C13H27NO3/c1-12(2,3)16-7-6-15-9-11-8-14-10-13(4,5)17-11/h11,14H,6-10H2,1-5H3
InChIKeyRHYNDAZUZDVFSA-UHFFFAOYSA-N
XLogP1.59
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.36
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(6,6-dimethylmorpholin-2-yl)methoxy]-N,N-dimethylpropan-1-amine
CID 114775638
2,2-dimethyl-6-(3-phenoxypropoxymethyl)morpholine
CID 114775379
2,2-dimethyl-6-[2-(1-methylpiperidin-2-yl)ethoxymethyl]morpholine
CID 107912985
2,2-dimethyl-6-(oxolan-3-ylmethoxymethyl)morpholine
CID 114775329
6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775626
6-(2-cyclopropylethyl)-2,2-dimethylmorpholine
CID 130847158
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-N-ethyl-N-methylacetamide
CID 114775649
2,2-dimethyl-6-[(5-methyl-1,2-oxazol-3-yl)methoxymethyl]morpholine
CID 114775307
2-[(6,6-dimethylmorpholin-2-yl)methoxy]propanenitrile
CID 114775428
6-[(2-methoxy-3-pyridinyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775440
2-[2-[(6,6-dimethylmorpholin-2-yl)methoxymethyl]phenyl]acetic acid
CID 106940905
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-N-prop-2-enylacetamide
CID 114775458

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine?
The IUPAC name of 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine (CID 114775589) is 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine.
What is the SMILES notation for 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine?
The canonical SMILES for 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine is CC(C)(C)OCCOCC1CNCC(C)(C)O1.
What is the InChIKey of 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine?
The InChIKey is RHYNDAZUZDVFSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3/c1-12(2,3)16-7-6-15-9-11-8-14-10-13(4,5)17-11/h11,14H,6-10H2,1-5H3.
What are the key properties of 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine?
2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine has a molecular weight of 245.36 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]morpholine is sourced from PubChem (CID 114775589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).