2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine

C6H7F8N — CID 12696964

IUPAC2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine
SMILESFC(F)C(F)(F)CNCC(F)(F)C(F)F
InChIInChI=1S/C6H7F8N/c7-3(8)5(11,12)1-15-2-6(13,14)4(9)10/h3-4,15H,1-2H2
InChIKeyCFVFZRMYKBQBFC-UHFFFAOYSA-N
MW245.11 g/mol
LogP2.38
Rot. Bonds6

About 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine

2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine (PubChem CID 12696964) has the molecular formula C6H7F8N and a molecular weight of 245.11 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine
PubChem CID12696964
Molecular FormulaC6H7F8N
Molecular Weight245.11 g/mol
Exact Mass245.05
IUPAC Name2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine
SMILESFC(F)C(F)(F)CNCC(F)(F)C(F)F
InChIInChI=1S/C6H7F8N/c7-3(8)5(11,12)1-15-2-6(13,14)4(9)10/h3-4,15H,1-2H2
InChIKeyCFVFZRMYKBQBFC-UHFFFAOYSA-N
XLogP2.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine?
The IUPAC name of 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine (CID 12696964) is 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine is FC(F)C(F)(F)CNCC(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine?
The InChIKey is CFVFZRMYKBQBFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F8N/c7-3(8)5(11,12)1-15-2-6(13,14)4(9)10/h3-4,15H,1-2H2.
What are the key properties of 2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine?
2,2,3,3-tetrafluoro-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine has a molecular weight of 245.11 g/mol, XLogP of 2.38, 6 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-N-(2,2,3,3-tetrafluoropropyl)propan-1-amine is sourced from PubChem (CID 12696964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).