3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine

C11H23NO2 — CID 47811795

IUPAC3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
SMILESCC1COCCN1CCOC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-10-9-13-7-5-12(10)6-8-14-11(2,3)4/h10H,5-9H2,1-4H3
InChIKeyZQTDHLNVJSLLAP-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.52
Rot. Bonds3

About 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine

3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine (PubChem CID 47811795) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine.

Molecular Properties

Compound Name3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
PubChem CID47811795
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
SMILESCC1COCCN1CCOC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-10-9-13-7-5-12(10)6-8-14-11(2,3)4/h10H,5-9H2,1-4H3
InChIKeyZQTDHLNVJSLLAP-UHFFFAOYSA-N
XLogP1.52
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The IUPAC name of 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine (CID 47811795) is 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine.
What is the SMILES notation for 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The canonical SMILES for 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine is CC1COCCN1CCOC(C)(C)C.
What is the InChIKey of 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The InChIKey is ZQTDHLNVJSLLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10-9-13-7-5-12(10)6-8-14-11(2,3)4/h10H,5-9H2,1-4H3.
What are the key properties of 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine has a molecular weight of 201.31 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine is sourced from PubChem (CID 47811795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).