2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine

C13H27NO3 — CID 68587894

IUPAC2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine
SMILESCCCCC(COC)(OCC)C1CNCCO1
InChIInChI=1S/C13H27NO3/c1-4-6-7-13(11-15-3,17-5-2)12-10-14-8-9-16-12/h12,14H,4-11H2,1-3H3
InChIKeyLDGHHHZPOFNSEY-UHFFFAOYSA-N
MW245.36 g/mol
LogP1.59
Rot. Bonds8

About 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine

2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine (PubChem CID 68587894) has the molecular formula C13H27NO3 and a molecular weight of 245.36 g/mol. Its IUPAC name is 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine.

Molecular Properties

Compound Name2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine
PubChem CID68587894
Molecular FormulaC13H27NO3
Molecular Weight245.36 g/mol
Exact Mass245.20
IUPAC Name2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine
SMILESCCCCC(COC)(OCC)C1CNCCO1
InChIInChI=1S/C13H27NO3/c1-4-6-7-13(11-15-3,17-5-2)12-10-14-8-9-16-12/h12,14H,4-11H2,1-3H3
InChIKeyLDGHHHZPOFNSEY-UHFFFAOYSA-N
XLogP1.59
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine?
The IUPAC name of 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine (CID 68587894) is 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine.
What is the SMILES notation for 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine?
The canonical SMILES for 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine is CCCCC(COC)(OCC)C1CNCCO1.
What is the InChIKey of 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine?
The InChIKey is LDGHHHZPOFNSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3/c1-4-6-7-13(11-15-3,17-5-2)12-10-14-8-9-16-12/h12,14H,4-11H2,1-3H3.
What are the key properties of 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine?
2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine has a molecular weight of 245.36 g/mol, XLogP of 1.59, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxy-1-methoxyhexan-2-yl)morpholine is sourced from PubChem (CID 68587894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).