2-hex-2-enylmorpholine

C10H19NO — CID 68590106

IUPAC2-hex-2-enylmorpholine
SMILESCCCC=CCC1CNCCO1
InChIInChI=1S/C10H19NO/c1-2-3-4-5-6-10-9-11-7-8-12-10/h4-5,10-11H,2-3,6-9H2,1H3
InChIKeyWYKIZSWSTRGMMO-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.72
Rot. Bonds4

About 2-hex-2-enylmorpholine

2-hex-2-enylmorpholine (PubChem CID 68590106) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-hex-2-enylmorpholine.

Molecular Properties

Compound Name2-hex-2-enylmorpholine
PubChem CID68590106
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-hex-2-enylmorpholine
SMILESCCCC=CCC1CNCCO1
InChIInChI=1S/C10H19NO/c1-2-3-4-5-6-10-9-11-7-8-12-10/h4-5,10-11H,2-3,6-9H2,1H3
InChIKeyWYKIZSWSTRGMMO-UHFFFAOYSA-N
XLogP1.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.72
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 2-hex-2-enylmorpholine?
The IUPAC name of 2-hex-2-enylmorpholine (CID 68590106) is 2-hex-2-enylmorpholine.
What is the SMILES notation for 2-hex-2-enylmorpholine?
The canonical SMILES for 2-hex-2-enylmorpholine is CCCC=CCC1CNCCO1.
What is the InChIKey of 2-hex-2-enylmorpholine?
The InChIKey is WYKIZSWSTRGMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-3-4-5-6-10-9-11-7-8-12-10/h4-5,10-11H,2-3,6-9H2,1H3.
What are the key properties of 2-hex-2-enylmorpholine?
2-hex-2-enylmorpholine has a molecular weight of 169.27 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hex-2-enylmorpholine is sourced from PubChem (CID 68590106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).