2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine

C12H24N2O2 — CID 43592634

IUPAC2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine
SMILESCC1(C)CN(C(CN)C2CCOC2)CCO1
InChIInChI=1S/C12H24N2O2/c1-12(2)9-14(4-6-16-12)11(7-13)10-3-5-15-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyANOCXLFDVJIBOX-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.46
Rot. Bonds3

About 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine

2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine (PubChem CID 43592634) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine
PubChem CID43592634
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine
SMILESCC1(C)CN(C(CN)C2CCOC2)CCO1
InChIInChI=1S/C12H24N2O2/c1-12(2)9-14(4-6-16-12)11(7-13)10-3-5-15-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyANOCXLFDVJIBOX-UHFFFAOYSA-N
XLogP0.46
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine (CID 43592634) is 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine is CC1(C)CN(C(CN)C2CCOC2)CCO1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine?
The InChIKey is ANOCXLFDVJIBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2)9-14(4-6-16-12)11(7-13)10-3-5-15-8-10/h10-11H,3-9,13H2,1-2H3.
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine?
2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine has a molecular weight of 228.34 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-2-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 43592634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).