1,2,2,2-tetrafluoroethanamine

C2H3F4N — CID 84731060

IUPAC1,2,2,2-tetrafluoroethanamine
SMILESNC(F)C(F)(F)F
InChIInChI=1S/C2H3F4N/c3-1(7)2(4,5)6/h1H,7H2
InChIKeyFNGIIQFQYRPILY-UHFFFAOYSA-N
MW117.05 g/mol
LogP0.80
Rot. Bonds

About 1,2,2,2-tetrafluoroethanamine

1,2,2,2-tetrafluoroethanamine (PubChem CID 84731060) has the molecular formula C2H3F4N and a molecular weight of 117.05 g/mol. Its IUPAC name is 1,2,2,2-tetrafluoroethanamine.

Molecular Properties

Compound Name1,2,2,2-tetrafluoroethanamine
PubChem CID84731060
Molecular FormulaC2H3F4N
Molecular Weight117.05 g/mol
Exact Mass117.02
IUPAC Name1,2,2,2-tetrafluoroethanamine
SMILESNC(F)C(F)(F)F
InChIInChI=1S/C2H3F4N/c3-1(7)2(4,5)6/h1H,7H2
InChIKeyFNGIIQFQYRPILY-UHFFFAOYSA-N
XLogP0.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.05
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Ethanamine, 2,2,2-trifluoro-
CID 9773
2,2,3,3,3-Pentafluoropropylamine
CID 79002
1,1,1,3,3,3-Hexafluoropropan-2-amine
CID 12224667
2,2,3,3-Tetrafluoropropan-1-amine hydrochloride
CID 21298755
2,2,3,3,3-Pentafluoropropylamine hydrochloride
CID 25210507
2,2,2-Trifluoroethylazanium
CID 7058078
2,3,3,3-Tetrafluoropropan-1-amine
CID 23423629
2,2,3,3,3-Pentafluoropropylazanium;chloride
CID 2776014
2,2,3,3-Tetrafluoropropan-1-amine
CID 12626048
1,2,2,3,3-Pentafluoropropan-1-amine
CID 18551453
1,3,3,3-Tetrafluoropropan-1-amine
CID 21946433
3,3,3-Trifluoropropan-1-amine;hydrofluoride
CID 22571478

Frequently Asked Questions

What is the IUPAC name of 1,2,2,2-tetrafluoroethanamine?
The IUPAC name of 1,2,2,2-tetrafluoroethanamine (CID 84731060) is 1,2,2,2-tetrafluoroethanamine.
What is the SMILES notation for 1,2,2,2-tetrafluoroethanamine?
The canonical SMILES for 1,2,2,2-tetrafluoroethanamine is NC(F)C(F)(F)F.
What is the InChIKey of 1,2,2,2-tetrafluoroethanamine?
The InChIKey is FNGIIQFQYRPILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3F4N/c3-1(7)2(4,5)6/h1H,7H2.
What are the key properties of 1,2,2,2-tetrafluoroethanamine?
1,2,2,2-tetrafluoroethanamine has a molecular weight of 117.05 g/mol, XLogP of 0.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,2-tetrafluoroethanamine is sourced from PubChem (CID 84731060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).