2-(1,1,2,2,2-pentafluoroethyl)morpholine

C6H8F5NO — CID 19435837

IUPAC2-(1,1,2,2,2-pentafluoroethyl)morpholine
SMILESFC(F)(F)C(F)(F)C1CNCCO1
InChIInChI=1S/C6H8F5NO/c7-5(8,6(9,10)11)4-3-12-1-2-13-4/h4,12H,1-3H2
InChIKeyRXEHTVOQXXNHHD-UHFFFAOYSA-N
MW205.13 g/mol
LogP1.17
Rot. Bonds1

About 2-(1,1,2,2,2-pentafluoroethyl)morpholine

2-(1,1,2,2,2-pentafluoroethyl)morpholine (PubChem CID 19435837) has the molecular formula C6H8F5NO and a molecular weight of 205.13 g/mol. Its IUPAC name is 2-(1,1,2,2,2-pentafluoroethyl)morpholine.

Molecular Properties

Compound Name2-(1,1,2,2,2-pentafluoroethyl)morpholine
PubChem CID19435837
Molecular FormulaC6H8F5NO
Molecular Weight205.13 g/mol
Exact Mass205.05
IUPAC Name2-(1,1,2,2,2-pentafluoroethyl)morpholine
SMILESFC(F)(F)C(F)(F)C1CNCCO1
InChIInChI=1S/C6H8F5NO/c7-5(8,6(9,10)11)4-3-12-1-2-13-4/h4,12H,1-3H2
InChIKeyRXEHTVOQXXNHHD-UHFFFAOYSA-N
XLogP1.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.13
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-(1,1,2,2,2-pentafluoroethyl)morpholine?
The IUPAC name of 2-(1,1,2,2,2-pentafluoroethyl)morpholine (CID 19435837) is 2-(1,1,2,2,2-pentafluoroethyl)morpholine.
What is the SMILES notation for 2-(1,1,2,2,2-pentafluoroethyl)morpholine?
The canonical SMILES for 2-(1,1,2,2,2-pentafluoroethyl)morpholine is FC(F)(F)C(F)(F)C1CNCCO1.
What is the InChIKey of 2-(1,1,2,2,2-pentafluoroethyl)morpholine?
The InChIKey is RXEHTVOQXXNHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F5NO/c7-5(8,6(9,10)11)4-3-12-1-2-13-4/h4,12H,1-3H2.
What are the key properties of 2-(1,1,2,2,2-pentafluoroethyl)morpholine?
2-(1,1,2,2,2-pentafluoroethyl)morpholine has a molecular weight of 205.13 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,2,2,2-pentafluoroethyl)morpholine is sourced from PubChem (CID 19435837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).