2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine

C14H28N2O2 — CID 62557885

IUPAC2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1COC(C)CN1CCNCC1CCOC1
InChIInChI=1S/C14H28N2O2/c1-3-14-11-18-12(2)9-16(14)6-5-15-8-13-4-7-17-10-13/h12-15H,3-11H2,1-2H3
InChIKeyOKQOOXZTHALNIT-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.11
Rot. Bonds6

About 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine

2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine (PubChem CID 62557885) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
PubChem CID62557885
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1COC(C)CN1CCNCC1CCOC1
InChIInChI=1S/C14H28N2O2/c1-3-14-11-18-12(2)9-16(14)6-5-15-8-13-4-7-17-10-13/h12-15H,3-11H2,1-2H3
InChIKeyOKQOOXZTHALNIT-UHFFFAOYSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.11
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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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The IUPAC name of 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine (CID 62557885) is 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The canonical SMILES for 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine is CCC1COC(C)CN1CCNCC1CCOC1.
What is the InChIKey of 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The InChIKey is OKQOOXZTHALNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-14-11-18-12(2)9-16(14)6-5-15-8-13-4-7-17-10-13/h12-15H,3-11H2,1-2H3.
What are the key properties of 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine has a molecular weight of 256.39 g/mol, XLogP of 1.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine is sourced from PubChem (CID 62557885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).