2-(2,2,3,3,3-pentafluoropropoxy)acetamide

C5H6F5NO2 — CID 103725375

IUPAC2-(2,2,3,3,3-pentafluoropropoxy)acetamide
SMILESNC(=O)COCC(F)(F)C(F)(F)F
InChIInChI=1S/C5H6F5NO2/c6-4(7,5(8,9)10)2-13-1-3(11)12/h1-2H2,(H2,11,12)
InChIKeyFFMBBSNDTKWUOT-UHFFFAOYSA-N
MW207.10 g/mol
LogP0.69
Rot. Bonds4

About 2-(2,2,3,3,3-pentafluoropropoxy)acetamide

2-(2,2,3,3,3-pentafluoropropoxy)acetamide (PubChem CID 103725375) has the molecular formula C5H6F5NO2 and a molecular weight of 207.10 g/mol. Its IUPAC name is 2-(2,2,3,3,3-pentafluoropropoxy)acetamide.

Molecular Properties

Compound Name2-(2,2,3,3,3-pentafluoropropoxy)acetamide
PubChem CID103725375
Molecular FormulaC5H6F5NO2
Molecular Weight207.10 g/mol
Exact Mass207.03
IUPAC Name2-(2,2,3,3,3-pentafluoropropoxy)acetamide
SMILESNC(=O)COCC(F)(F)C(F)(F)F
InChIInChI=1S/C5H6F5NO2/c6-4(7,5(8,9)10)2-13-1-3(11)12/h1-2H2,(H2,11,12)
InChIKeyFFMBBSNDTKWUOT-UHFFFAOYSA-N
XLogP0.69
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.10
LogP ≤ 50.69
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-(2,2,3,3,3-pentafluoropropoxy)acetamide?
The IUPAC name of 2-(2,2,3,3,3-pentafluoropropoxy)acetamide (CID 103725375) is 2-(2,2,3,3,3-pentafluoropropoxy)acetamide.
What is the SMILES notation for 2-(2,2,3,3,3-pentafluoropropoxy)acetamide?
The canonical SMILES for 2-(2,2,3,3,3-pentafluoropropoxy)acetamide is NC(=O)COCC(F)(F)C(F)(F)F.
What is the InChIKey of 2-(2,2,3,3,3-pentafluoropropoxy)acetamide?
The InChIKey is FFMBBSNDTKWUOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F5NO2/c6-4(7,5(8,9)10)2-13-1-3(11)12/h1-2H2,(H2,11,12).
What are the key properties of 2-(2,2,3,3,3-pentafluoropropoxy)acetamide?
2-(2,2,3,3,3-pentafluoropropoxy)acetamide has a molecular weight of 207.10 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,3,3,3-pentafluoropropoxy)acetamide is sourced from PubChem (CID 103725375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).