3-[(2-methylpropan-2-yl)oxymethyl]morpholine

C9H19NO2 — CID 58365003

IUPAC3-[(2-methylpropan-2-yl)oxymethyl]morpholine
SMILESCC(C)(C)OCC1COCCN1
InChIInChI=1S/C9H19NO2/c1-9(2,3)12-7-8-6-11-5-4-10-8/h8,10H,4-7H2,1-3H3
InChIKeyDKAZOIBXVLFWIF-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.79
Rot. Bonds2

About 3-[(2-methylpropan-2-yl)oxymethyl]morpholine

3-[(2-methylpropan-2-yl)oxymethyl]morpholine (PubChem CID 58365003) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-[(2-methylpropan-2-yl)oxymethyl]morpholine.

Molecular Properties

Compound Name3-[(2-methylpropan-2-yl)oxymethyl]morpholine
PubChem CID58365003
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-[(2-methylpropan-2-yl)oxymethyl]morpholine
SMILESCC(C)(C)OCC1COCCN1
InChIInChI=1S/C9H19NO2/c1-9(2,3)12-7-8-6-11-5-4-10-8/h8,10H,4-7H2,1-3H3
InChIKeyDKAZOIBXVLFWIF-UHFFFAOYSA-N
XLogP0.79
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylpropan-2-yl)oxymethyl]morpholine?
The IUPAC name of 3-[(2-methylpropan-2-yl)oxymethyl]morpholine (CID 58365003) is 3-[(2-methylpropan-2-yl)oxymethyl]morpholine.
What is the SMILES notation for 3-[(2-methylpropan-2-yl)oxymethyl]morpholine?
The canonical SMILES for 3-[(2-methylpropan-2-yl)oxymethyl]morpholine is CC(C)(C)OCC1COCCN1.
What is the InChIKey of 3-[(2-methylpropan-2-yl)oxymethyl]morpholine?
The InChIKey is DKAZOIBXVLFWIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2,3)12-7-8-6-11-5-4-10-8/h8,10H,4-7H2,1-3H3.
What are the key properties of 3-[(2-methylpropan-2-yl)oxymethyl]morpholine?
3-[(2-methylpropan-2-yl)oxymethyl]morpholine has a molecular weight of 173.26 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylpropan-2-yl)oxymethyl]morpholine is sourced from PubChem (CID 58365003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).