2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide

C11H14F8N2O2 — CID 3352188

IUPAC2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide
SMILESO=C(NCCN1CCOCC1)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C11H14F8N2O2/c12-7(13)9(14,15)11(18,19)10(16,17)8(22)20-1-2-21-3-5-23-6-4-21/h7H,1-6H2,(H,20,22)
InChIKeyZFXOUQXHIHRZBF-UHFFFAOYSA-N
MW358.23 g/mol
LogP1.61
Rot. Bonds7

About 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide

2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide (PubChem CID 3352188) has the molecular formula C11H14F8N2O2 and a molecular weight of 358.23 g/mol. Its IUPAC name is 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide.

Molecular Properties

Compound Name2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide
PubChem CID3352188
Molecular FormulaC11H14F8N2O2
Molecular Weight358.23 g/mol
Exact Mass358.09
IUPAC Name2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide
SMILESO=C(NCCN1CCOCC1)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C11H14F8N2O2/c12-7(13)9(14,15)11(18,19)10(16,17)8(22)20-1-2-21-3-5-23-6-4-21/h7H,1-6H2,(H,20,22)
InChIKeyZFXOUQXHIHRZBF-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.23
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide?
The IUPAC name of 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide (CID 3352188) is 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide.
What is the SMILES notation for 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide?
The canonical SMILES for 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide is O=C(NCCN1CCOCC1)C(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide?
The InChIKey is ZFXOUQXHIHRZBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F8N2O2/c12-7(13)9(14,15)11(18,19)10(16,17)8(22)20-1-2-21-3-5-23-6-4-21/h7H,1-6H2,(H,20,22).
What are the key properties of 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide?
2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide has a molecular weight of 358.23 g/mol, XLogP of 1.61, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,5,5-octafluoro-N-(2-morpholin-4-ylethyl)pentanamide is sourced from PubChem (CID 3352188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).