(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine

C12H24N2O — CID 70892663

IUPAC(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine
SMILESCCC(N)/C=C\CN1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h5-6,10-12H,4,7-9,13H2,1-3H3/b6-5-/t10-,11+,12?
InChIKeyXSGZNFPTKDYYFL-UFFRRDCGSA-N
MW212.34 g/mol
LogP1.39
Rot. Bonds4

About (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine

(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine (PubChem CID 70892663) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine.

Molecular Properties

Compound Name(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine
PubChem CID70892663
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine
SMILESCCC(N)/C=C\CN1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h5-6,10-12H,4,7-9,13H2,1-3H3/b6-5-/t10-,11+,12?
InChIKeyXSGZNFPTKDYYFL-UFFRRDCGSA-N
XLogP1.39
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 ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine?
The IUPAC name of (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine (CID 70892663) is (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine.
What is the SMILES notation for (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine?
The canonical SMILES for (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine is CCC(N)/C=C\CN1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine?
The InChIKey is XSGZNFPTKDYYFL-UFFRRDCGSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-12(13)6-5-7-14-8-10(2)15-11(3)9-14/h5-6,10-12H,4,7-9,13H2,1-3H3/b6-5-/t10-,11+,12?.
What are the key properties of (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine?
(Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine has a molecular weight of 212.34 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]hex-4-en-3-amine is sourced from PubChem (CID 70892663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).