4-but-2-enyl-2-(methoxymethyl)morpholine

C10H19NO2 — CID 173167340

IUPAC4-but-2-enyl-2-(methoxymethyl)morpholine
SMILESCC=CCN1CCOC(COC)C1
InChIInChI=1S/C10H19NO2/c1-3-4-5-11-6-7-13-10(8-11)9-12-2/h3-4,10H,5-9H2,1-2H3
InChIKeyGZSGJHNTXVDHTC-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.91
Rot. Bonds4

About 4-but-2-enyl-2-(methoxymethyl)morpholine

4-but-2-enyl-2-(methoxymethyl)morpholine (PubChem CID 173167340) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-but-2-enyl-2-(methoxymethyl)morpholine.

Molecular Properties

Compound Name4-but-2-enyl-2-(methoxymethyl)morpholine
PubChem CID173167340
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name4-but-2-enyl-2-(methoxymethyl)morpholine
SMILESCC=CCN1CCOC(COC)C1
InChIInChI=1S/C10H19NO2/c1-3-4-5-11-6-7-13-10(8-11)9-12-2/h3-4,10H,5-9H2,1-2H3
InChIKeyGZSGJHNTXVDHTC-UHFFFAOYSA-N
XLogP0.91
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 4-but-2-enyl-2-(methoxymethyl)morpholine?
The IUPAC name of 4-but-2-enyl-2-(methoxymethyl)morpholine (CID 173167340) is 4-but-2-enyl-2-(methoxymethyl)morpholine.
What is the SMILES notation for 4-but-2-enyl-2-(methoxymethyl)morpholine?
The canonical SMILES for 4-but-2-enyl-2-(methoxymethyl)morpholine is CC=CCN1CCOC(COC)C1.
What is the InChIKey of 4-but-2-enyl-2-(methoxymethyl)morpholine?
The InChIKey is GZSGJHNTXVDHTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-4-5-11-6-7-13-10(8-11)9-12-2/h3-4,10H,5-9H2,1-2H3.
What are the key properties of 4-but-2-enyl-2-(methoxymethyl)morpholine?
4-but-2-enyl-2-(methoxymethyl)morpholine has a molecular weight of 185.27 g/mol, XLogP of 0.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-but-2-enyl-2-(methoxymethyl)morpholine is sourced from PubChem (CID 173167340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).