2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one

C10H10F8N2O2 — CID 19577200

IUPAC2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one
SMILESO=C(C(F)C(F)(F)F)N1CCN(C(=O)C(F)C(F)(F)F)CC1
InChIInChI=1S/C10H10F8N2O2/c11-5(9(13,14)15)7(21)19-1-2-20(4-3-19)8(22)6(12)10(16,17)18/h5-6H,1-4H2
InChIKeyNQNIAQROQKFLKJ-UHFFFAOYSA-N
MW342.19 g/mol
LogP1.46
Rot. Bonds2

About 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one

2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one (PubChem CID 19577200) has the molecular formula C10H10F8N2O2 and a molecular weight of 342.19 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one.

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one
PubChem CID19577200
Molecular FormulaC10H10F8N2O2
Molecular Weight342.19 g/mol
Exact Mass342.06
IUPAC Name2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one
SMILESO=C(C(F)C(F)(F)F)N1CCN(C(=O)C(F)C(F)(F)F)CC1
InChIInChI=1S/C10H10F8N2O2/c11-5(9(13,14)15)7(21)19-1-2-20(4-3-19)8(22)6(12)10(16,17)18/h5-6H,1-4H2
InChIKeyNQNIAQROQKFLKJ-UHFFFAOYSA-N
XLogP1.46
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.19
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one?
The IUPAC name of 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one (CID 19577200) is 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one.
What is the SMILES notation for 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one?
The canonical SMILES for 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one is O=C(C(F)C(F)(F)F)N1CCN(C(=O)C(F)C(F)(F)F)CC1.
What is the InChIKey of 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one?
The InChIKey is NQNIAQROQKFLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F8N2O2/c11-5(9(13,14)15)7(21)19-1-2-20(4-3-19)8(22)6(12)10(16,17)18/h5-6H,1-4H2.
What are the key properties of 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one?
2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one has a molecular weight of 342.19 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-1-[4-(2,3,3,3-tetrafluoropropanoyl)piperazin-1-yl]propan-1-one is sourced from PubChem (CID 19577200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).