(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine

C12H24N2O — CID 70892511

IUPAC(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine
SMILESC/C=C(/N)CCCN1CC(C)OC(C)C1
InChIInChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h4,10-11H,5-9,13H2,1-3H3/b12-4+
InChIKeyOTWHUSTVSIEMLI-UUILKARUSA-N
MW212.34 g/mol
LogP1.74
Rot. Bonds4

About (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine

(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine (PubChem CID 70892511) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine.

Molecular Properties

Compound Name(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine
PubChem CID70892511
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine
SMILESC/C=C(/N)CCCN1CC(C)OC(C)C1
InChIInChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h4,10-11H,5-9,13H2,1-3H3/b12-4+
InChIKeyOTWHUSTVSIEMLI-UUILKARUSA-N
XLogP1.74
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine?
The IUPAC name of (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine (CID 70892511) is (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine.
What is the SMILES notation for (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine?
The canonical SMILES for (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine is C/C=C(/N)CCCN1CC(C)OC(C)C1.
What is the InChIKey of (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine?
The InChIKey is OTWHUSTVSIEMLI-UUILKARUSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h4,10-11H,5-9,13H2,1-3H3/b12-4+.
What are the key properties of (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine?
(E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine has a molecular weight of 212.34 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-(2,6-dimethylmorpholin-4-yl)hex-2-en-3-amine is sourced from PubChem (CID 70892511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).