(2S)-2-ethenylmorpholine

C6H11NO — CID 86316049

IUPAC(2S)-2-ethenylmorpholine
SMILESC=C[C@H]1CNCCO1
InChIInChI=1S/C6H11NO/c1-2-6-5-7-3-4-8-6/h2,6-7H,1,3-5H2/t6-/m0/s1
InChIKeyGYEQLVFBKDAMHD-LURJTMIESA-N
MW113.16 g/mol
LogP0.16
Rot. Bonds1

About (2S)-2-ethenylmorpholine

(2S)-2-ethenylmorpholine (PubChem CID 86316049) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (2S)-2-ethenylmorpholine.

Molecular Properties

Compound Name(2S)-2-ethenylmorpholine
PubChem CID86316049
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(2S)-2-ethenylmorpholine
SMILESC=C[C@H]1CNCCO1
InChIInChI=1S/C6H11NO/c1-2-6-5-7-3-4-8-6/h2,6-7H,1,3-5H2/t6-/m0/s1
InChIKeyGYEQLVFBKDAMHD-LURJTMIESA-N
XLogP0.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethenylmorpholine?
The IUPAC name of (2S)-2-ethenylmorpholine (CID 86316049) is (2S)-2-ethenylmorpholine.
What is the SMILES notation for (2S)-2-ethenylmorpholine?
The canonical SMILES for (2S)-2-ethenylmorpholine is C=C[C@H]1CNCCO1.
What is the InChIKey of (2S)-2-ethenylmorpholine?
The InChIKey is GYEQLVFBKDAMHD-LURJTMIESA-N. The full InChI is InChI=1S/C6H11NO/c1-2-6-5-7-3-4-8-6/h2,6-7H,1,3-5H2/t6-/m0/s1.
What are the key properties of (2S)-2-ethenylmorpholine?
(2S)-2-ethenylmorpholine has a molecular weight of 113.16 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethenylmorpholine is sourced from PubChem (CID 86316049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).