4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine

C24H44N2O2 — CID 174958404

IUPAC4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine
SMILESCC(C)(C=CCCCCC=CC(C)(C)CN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C24H44N2O2/c1-23(2,21-25-13-17-27-18-14-25)11-9-7-5-6-8-10-12-24(3,4)22-26-15-19-28-20-16-26/h9-12H,5-8,13-22H2,1-4H3
InChIKeySOCPMJSQVRFZPR-UHFFFAOYSA-N
MW392.63 g/mol
LogP4.38
Rot. Bonds11

About 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine

4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine (PubChem CID 174958404) has the molecular formula C24H44N2O2 and a molecular weight of 392.63 g/mol. Its IUPAC name is 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine.

Molecular Properties

Compound Name4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine
PubChem CID174958404
Molecular FormulaC24H44N2O2
Molecular Weight392.63 g/mol
Exact Mass392.34
IUPAC Name4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine
SMILESCC(C)(C=CCCCCC=CC(C)(C)CN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C24H44N2O2/c1-23(2,21-25-13-17-27-18-14-25)11-9-7-5-6-8-10-12-24(3,4)22-26-15-19-28-20-16-26/h9-12H,5-8,13-22H2,1-4H3
InChIKeySOCPMJSQVRFZPR-UHFFFAOYSA-N
XLogP4.38
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.63
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-4,4-dimethylpent-2-enyl]morpholine
CID 21060370
2-methyl-1-morpholin-4-ylpropan-2-amine;dihydrochloride
CID 118511951
4-[(Z)-non-2-enyl]morpholine
CID 101051916
1,2-dimorpholin-4-ylpropan-2-amine
CID 57479397
1,2-dimorpholin-4-ylpropan-2-ol
CID 154210663
4-[(E)-2-ethyl-2,6-dimethyloct-3-enyl]morpholine
CID 166864833
1-(2,2-dimethylpropyl)-4-methylpiperazine;4-(2,2-dimethylpropyl)morpholine;methane
CID 162058346
4-oct-7-enylmorpholine
CID 67850758
2-methyl-1-(1,4-oxazepan-4-yl)propan-2-ol
CID 62972933
1-[(E)-2,2,5,5-tetramethylhex-3-enyl]pyrrolidine
CID 146324127
2-methyl-2-(morpholin-4-ylmethyl)pentanal
CID 62276739
2-[(2-methyl-1-morpholin-4-ylpropan-2-yl)amino]acetaldehyde
CID 91288121

Frequently Asked Questions

What is the IUPAC name of 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine?
The IUPAC name of 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine (CID 174958404) is 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine.
What is the SMILES notation for 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine?
The canonical SMILES for 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine is CC(C)(C=CCCCCC=CC(C)(C)CN1CCOCC1)CN1CCOCC1.
What is the InChIKey of 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine?
The InChIKey is SOCPMJSQVRFZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2O2/c1-23(2,21-25-13-17-27-18-14-25)11-9-7-5-6-8-10-12-24(3,4)22-26-15-19-28-20-16-26/h9-12H,5-8,13-22H2,1-4H3.
What are the key properties of 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine?
4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine has a molecular weight of 392.63 g/mol, XLogP of 4.38, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2,11,11-tetramethyl-12-morpholin-4-yldodeca-3,9-dienyl)morpholine is sourced from PubChem (CID 174958404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).