N,2,2,3,3,4,4,5,5-nonafluoropentanamide

C5H2F9NO — CID 123908269

IUPACN,2,2,3,3,4,4,5,5-nonafluoropentanamide
SMILESO=C(NF)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C5H2F9NO/c6-1(7)3(8,9)5(12,13)4(10,11)2(16)15-14/h1H,(H,15,16)
InChIKeyVDBJOZSPLDVGBD-UHFFFAOYSA-N
MW263.06 g/mol
LogP2.16
Rot. Bonds4

About N,2,2,3,3,4,4,5,5-nonafluoropentanamide

N,2,2,3,3,4,4,5,5-nonafluoropentanamide (PubChem CID 123908269) has the molecular formula C5H2F9NO and a molecular weight of 263.06 g/mol. Its IUPAC name is N,2,2,3,3,4,4,5,5-nonafluoropentanamide.

Molecular Properties

Compound NameN,2,2,3,3,4,4,5,5-nonafluoropentanamide
PubChem CID123908269
Molecular FormulaC5H2F9NO
Molecular Weight263.06 g/mol
Exact Mass263.00
IUPAC NameN,2,2,3,3,4,4,5,5-nonafluoropentanamide
SMILESO=C(NF)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C5H2F9NO/c6-1(7)3(8,9)5(12,13)4(10,11)2(16)15-14/h1H,(H,15,16)
InChIKeyVDBJOZSPLDVGBD-UHFFFAOYSA-N
XLogP2.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.06
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,2,2,3,3,4,4,5,5-nonafluoropentanamide?
The IUPAC name of N,2,2,3,3,4,4,5,5-nonafluoropentanamide (CID 123908269) is N,2,2,3,3,4,4,5,5-nonafluoropentanamide.
What is the SMILES notation for N,2,2,3,3,4,4,5,5-nonafluoropentanamide?
The canonical SMILES for N,2,2,3,3,4,4,5,5-nonafluoropentanamide is O=C(NF)C(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of N,2,2,3,3,4,4,5,5-nonafluoropentanamide?
The InChIKey is VDBJOZSPLDVGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F9NO/c6-1(7)3(8,9)5(12,13)4(10,11)2(16)15-14/h1H,(H,15,16).
What are the key properties of N,2,2,3,3,4,4,5,5-nonafluoropentanamide?
N,2,2,3,3,4,4,5,5-nonafluoropentanamide has a molecular weight of 263.06 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,3,3,4,4,5,5-nonafluoropentanamide is sourced from PubChem (CID 123908269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).