4-dodecyl-2,6-dimethylmorpholine

C18H37NO — CID 3014032

IUPAC4-dodecyl-2,6-dimethylmorpholine
SMILESCCCCCCCCCCCCN1CC(C)OC(C)C1
InChIInChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-17(2)20-18(3)16-19/h17-18H,4-16H2,1-3H3
InChIKeySBUKOHLFHYSZNG-UHFFFAOYSA-N
MW283.50 g/mol
LogP5.02
Rot. Bonds11

About 4-dodecyl-2,6-dimethylmorpholine

4-dodecyl-2,6-dimethylmorpholine (PubChem CID 3014032) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 4-dodecyl-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-dodecyl-2,6-dimethylmorpholine
PubChem CID3014032
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name4-dodecyl-2,6-dimethylmorpholine
SMILESCCCCCCCCCCCCN1CC(C)OC(C)C1
InChIInChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-17(2)20-18(3)16-19/h17-18H,4-16H2,1-3H3
InChIKeySBUKOHLFHYSZNG-UHFFFAOYSA-N
XLogP5.02
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.50
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-dodecyl-2,6-dimethylmorpholine?
The IUPAC name of 4-dodecyl-2,6-dimethylmorpholine (CID 3014032) is 4-dodecyl-2,6-dimethylmorpholine.
What is the SMILES notation for 4-dodecyl-2,6-dimethylmorpholine?
The canonical SMILES for 4-dodecyl-2,6-dimethylmorpholine is CCCCCCCCCCCCN1CC(C)OC(C)C1.
What is the InChIKey of 4-dodecyl-2,6-dimethylmorpholine?
The InChIKey is SBUKOHLFHYSZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-17(2)20-18(3)16-19/h17-18H,4-16H2,1-3H3.
What are the key properties of 4-dodecyl-2,6-dimethylmorpholine?
4-dodecyl-2,6-dimethylmorpholine has a molecular weight of 283.50 g/mol, XLogP of 5.02, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dodecyl-2,6-dimethylmorpholine is sourced from PubChem (CID 3014032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).