1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine

C8H16N2O — CID 89143496

IUPAC1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine
SMILESC=C(N)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C8H16N2O/c1-6-4-10(8(3)9)5-7(2)11-6/h6-7H,3-5,9H2,1-2H3/t6-,7+
InChIKeyNWFDXTNZEFBCGO-KNVOCYPGSA-N
MW156.23 g/mol
LogP0.53
Rot. Bonds1

About 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine

1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine (PubChem CID 89143496) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine.

Molecular Properties

Compound Name1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine
PubChem CID89143496
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine
SMILESC=C(N)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C8H16N2O/c1-6-4-10(8(3)9)5-7(2)11-6/h6-7H,3-5,9H2,1-2H3/t6-,7+
InChIKeyNWFDXTNZEFBCGO-KNVOCYPGSA-N
XLogP0.53
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine?
The IUPAC name of 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine (CID 89143496) is 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine.
What is the SMILES notation for 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine?
The canonical SMILES for 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine is C=C(N)N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine?
The InChIKey is NWFDXTNZEFBCGO-KNVOCYPGSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-4-10(8(3)9)5-7(2)11-6/h6-7H,3-5,9H2,1-2H3/t6-,7+.
What are the key properties of 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine?
1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine has a molecular weight of 156.23 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethenamine is sourced from PubChem (CID 89143496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).