1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide

C5H3F11N2O2S — CID 155317025

IUPAC1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide
SMILESNNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C5H3F11N2O2S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)21(19,20)18-17/h18H,17H2
InChIKeyKLJYDAIBLNBUPW-UHFFFAOYSA-N
MW364.14 g/mol
LogP1.84
Rot. Bonds5

About 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide

1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide (PubChem CID 155317025) has the molecular formula C5H3F11N2O2S and a molecular weight of 364.14 g/mol. Its IUPAC name is 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide.

Molecular Properties

Compound Name1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide
PubChem CID155317025
Molecular FormulaC5H3F11N2O2S
Molecular Weight364.14 g/mol
Exact Mass363.97
IUPAC Name1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide
SMILESNNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C5H3F11N2O2S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)21(19,20)18-17/h18H,17H2
InChIKeyKLJYDAIBLNBUPW-UHFFFAOYSA-N
XLogP1.84
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.14
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

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lithium;hydride;N-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)sulfamoyl fluoride
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CID 173199731
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptacosafluoro-N-propyltridecane-1-sulfonamide
CID 165364439
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluoro-N-(2-hydroxyethyl)decane-1-sulfonamide
CID 57144434
sodium;hydride;1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-trimethylsilylhexane-1-sulfonamide
CID 173151402
1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N-propylpentane-1-sulfonamide
CID 19931113
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-hydroxyprop-2-enyl)octane-1-sulfonamide
CID 165362509
N-[6-amino-4-(2-aminoethyl)hexyl]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide
CID 90962469
2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonylamino)acetic acid
CID 139595852
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,17-pentatriacontafluoroheptadecane-1-sulfonate
CID 23533140

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide?
The IUPAC name of 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide (CID 155317025) is 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide.
What is the SMILES notation for 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide?
The canonical SMILES for 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide is NNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide?
The InChIKey is KLJYDAIBLNBUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F11N2O2S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)21(19,20)18-17/h18H,17H2.
What are the key properties of 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide?
1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide has a molecular weight of 364.14 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonohydrazide is sourced from PubChem (CID 155317025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).