N,2,2,3-tetrafluoropropanamide

C3H3F4NO — CID 54471112

IUPACN,2,2,3-tetrafluoropropanamide
SMILESO=C(NF)C(F)(F)CF
InChIInChI=1S/C3H3F4NO/c4-1-3(5,6)2(9)8-7/h1H2,(H,8,9)
InChIKeyGOIYUJLWHJQNRS-UHFFFAOYSA-N
MW145.05 g/mol
LogP0.59
Rot. Bonds2

About N,2,2,3-tetrafluoropropanamide

N,2,2,3-tetrafluoropropanamide (PubChem CID 54471112) has the molecular formula C3H3F4NO and a molecular weight of 145.05 g/mol. Its IUPAC name is N,2,2,3-tetrafluoropropanamide.

Molecular Properties

Compound NameN,2,2,3-tetrafluoropropanamide
PubChem CID54471112
Molecular FormulaC3H3F4NO
Molecular Weight145.05 g/mol
Exact Mass145.02
IUPAC NameN,2,2,3-tetrafluoropropanamide
SMILESO=C(NF)C(F)(F)CF
InChIInChI=1S/C3H3F4NO/c4-1-3(5,6)2(9)8-7/h1H2,(H,8,9)
InChIKeyGOIYUJLWHJQNRS-UHFFFAOYSA-N
XLogP0.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.05
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,2,2,3-tetrafluoropropanamide?
The IUPAC name of N,2,2,3-tetrafluoropropanamide (CID 54471112) is N,2,2,3-tetrafluoropropanamide.
What is the SMILES notation for N,2,2,3-tetrafluoropropanamide?
The canonical SMILES for N,2,2,3-tetrafluoropropanamide is O=C(NF)C(F)(F)CF.
What is the InChIKey of N,2,2,3-tetrafluoropropanamide?
The InChIKey is GOIYUJLWHJQNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F4NO/c4-1-3(5,6)2(9)8-7/h1H2,(H,8,9).
What are the key properties of N,2,2,3-tetrafluoropropanamide?
N,2,2,3-tetrafluoropropanamide has a molecular weight of 145.05 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,3-tetrafluoropropanamide is sourced from PubChem (CID 54471112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).