2,2,3,3-tetrafluoro-3-iodopropanamide

C3H2F4INO — CID 10945538

IUPAC2,2,3,3-tetrafluoro-3-iodopropanamide
SMILESNC(=O)C(F)(F)C(F)(F)I
InChIInChI=1S/C3H2F4INO/c4-2(5,1(9)10)3(6,7)8/h(H2,9,10)
InChIKeyCHQKKMUDLQNTKC-UHFFFAOYSA-N
MW270.95 g/mol
LogP1.13
Rot. Bonds2

About 2,2,3,3-tetrafluoro-3-iodopropanamide

2,2,3,3-tetrafluoro-3-iodopropanamide (PubChem CID 10945538) has the molecular formula C3H2F4INO and a molecular weight of 270.95 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-3-iodopropanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-3-iodopropanamide
PubChem CID10945538
Molecular FormulaC3H2F4INO
Molecular Weight270.95 g/mol
Exact Mass270.91
IUPAC Name2,2,3,3-tetrafluoro-3-iodopropanamide
SMILESNC(=O)C(F)(F)C(F)(F)I
InChIInChI=1S/C3H2F4INO/c4-2(5,1(9)10)3(6,7)8/h(H2,9,10)
InChIKeyCHQKKMUDLQNTKC-UHFFFAOYSA-N
XLogP1.13
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.95
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-3-iodopropanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-3-iodopropanamide (CID 10945538) is 2,2,3,3-tetrafluoro-3-iodopropanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-3-iodopropanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-3-iodopropanamide is NC(=O)C(F)(F)C(F)(F)I.
What is the InChIKey of 2,2,3,3-tetrafluoro-3-iodopropanamide?
The InChIKey is CHQKKMUDLQNTKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F4INO/c4-2(5,1(9)10)3(6,7)8/h(H2,9,10).
What are the key properties of 2,2,3,3-tetrafluoro-3-iodopropanamide?
2,2,3,3-tetrafluoro-3-iodopropanamide has a molecular weight of 270.95 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-3-iodopropanamide is sourced from PubChem (CID 10945538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).