2-hex-1-en-2-ylmorpholine

C10H19NO — CID 68588537

IUPAC2-hex-1-en-2-ylmorpholine
SMILESC=C(CCCC)C1CNCCO1
InChIInChI=1S/C10H19NO/c1-3-4-5-9(2)10-8-11-6-7-12-10/h10-11H,2-8H2,1H3
InChIKeyALPPCRWEDUWING-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.72
Rot. Bonds4

About 2-hex-1-en-2-ylmorpholine

2-hex-1-en-2-ylmorpholine (PubChem CID 68588537) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-hex-1-en-2-ylmorpholine.

Molecular Properties

Compound Name2-hex-1-en-2-ylmorpholine
PubChem CID68588537
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-hex-1-en-2-ylmorpholine
SMILESC=C(CCCC)C1CNCCO1
InChIInChI=1S/C10H19NO/c1-3-4-5-9(2)10-8-11-6-7-12-10/h10-11H,2-8H2,1H3
InChIKeyALPPCRWEDUWING-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-1-en-2-ylmorpholine?
The IUPAC name of 2-hex-1-en-2-ylmorpholine (CID 68588537) is 2-hex-1-en-2-ylmorpholine.
What is the SMILES notation for 2-hex-1-en-2-ylmorpholine?
The canonical SMILES for 2-hex-1-en-2-ylmorpholine is C=C(CCCC)C1CNCCO1.
What is the InChIKey of 2-hex-1-en-2-ylmorpholine?
The InChIKey is ALPPCRWEDUWING-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-4-5-9(2)10-8-11-6-7-12-10/h10-11H,2-8H2,1H3.
What are the key properties of 2-hex-1-en-2-ylmorpholine?
2-hex-1-en-2-ylmorpholine 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-1-en-2-ylmorpholine is sourced from PubChem (CID 68588537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).