4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine

C14H28N2O — CID 18726559

IUPAC4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine
SMILESCC1CCN(CCN2CCOCC2)CC1(C)C
InChIInChI=1S/C14H28N2O/c1-13-4-5-16(12-14(13,2)3)7-6-15-8-10-17-11-9-15/h13H,4-12H2,1-3H3
InChIKeyZBOATIRFYHIUIH-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.69
Rot. Bonds3

About 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine

4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine (PubChem CID 18726559) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine
PubChem CID18726559
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine
SMILESCC1CCN(CCN2CCOCC2)CC1(C)C
InChIInChI=1S/C14H28N2O/c1-13-4-5-16(12-14(13,2)3)7-6-15-8-10-17-11-9-15/h13H,4-12H2,1-3H3
InChIKeyZBOATIRFYHIUIH-UHFFFAOYSA-N
XLogP1.69
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine (CID 18726559) is 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine is CC1CCN(CCN2CCOCC2)CC1(C)C.
What is the InChIKey of 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine?
The InChIKey is ZBOATIRFYHIUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-13-4-5-16(12-14(13,2)3)7-6-15-8-10-17-11-9-15/h13H,4-12H2,1-3H3.
What are the key properties of 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine?
4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine has a molecular weight of 240.39 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,3,4-trimethylpiperidin-1-yl)ethyl]morpholine is sourced from PubChem (CID 18726559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).