(Z)-6,6,6-trifluorohex-2-enamide

C6H8F3NO — CID 55266504

IUPAC(Z)-6,6,6-trifluorohex-2-enamide
SMILESNC(=O)/C=C\CCC(F)(F)F
InChIInChI=1S/C6H8F3NO/c7-6(8,9)4-2-1-3-5(10)11/h1,3H,2,4H2,(H2,10,11)/b3-1-
InChIKeySYNXUEMWPDFPJH-IWQZZHSRSA-N
MW167.13 g/mol
LogP1.37
Rot. Bonds3

About (Z)-6,6,6-trifluorohex-2-enamide

(Z)-6,6,6-trifluorohex-2-enamide (PubChem CID 55266504) has the molecular formula C6H8F3NO and a molecular weight of 167.13 g/mol. Its IUPAC name is (Z)-6,6,6-trifluorohex-2-enamide.

Molecular Properties

Compound Name(Z)-6,6,6-trifluorohex-2-enamide
PubChem CID55266504
Molecular FormulaC6H8F3NO
Molecular Weight167.13 g/mol
Exact Mass167.06
IUPAC Name(Z)-6,6,6-trifluorohex-2-enamide
SMILESNC(=O)/C=C\CCC(F)(F)F
InChIInChI=1S/C6H8F3NO/c7-6(8,9)4-2-1-3-5(10)11/h1,3H,2,4H2,(H2,10,11)/b3-1-
InChIKeySYNXUEMWPDFPJH-IWQZZHSRSA-N
XLogP1.37
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.13
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

cis-2-Pentenoic acid amide
CID 6432143
2-Pentenamide, (2E)-
CID 5973527
(E)-hex-2-enamide
CID 6505436
cis-2-Hexenoic acid amide
CID 5463548
(E)-4,4,5,5,6,6,6-heptafluorohex-2-enamide
CID 134900883
pentenamid-Konzentrationen
CID 139986
Hexene carboxylic acid amide
CID 54092131
(2Z)-2-fluorohexa-2,5-dienamide
CID 87881751
4,4,5,6,6-Pentafluorohexa-2,5-dienamide
CID 88728990
4,4,5,5,6,6,7-Heptafluorohept-2-enamide
CID 89922233
5-Fluoropent-2-enamide
CID 141430540
5,5,5-Trifluoropent-2-enamide
CID 154272221

Frequently Asked Questions

What is the IUPAC name of (Z)-6,6,6-trifluorohex-2-enamide?
The IUPAC name of (Z)-6,6,6-trifluorohex-2-enamide (CID 55266504) is (Z)-6,6,6-trifluorohex-2-enamide.
What is the SMILES notation for (Z)-6,6,6-trifluorohex-2-enamide?
The canonical SMILES for (Z)-6,6,6-trifluorohex-2-enamide is NC(=O)/C=C\CCC(F)(F)F.
What is the InChIKey of (Z)-6,6,6-trifluorohex-2-enamide?
The InChIKey is SYNXUEMWPDFPJH-IWQZZHSRSA-N. The full InChI is InChI=1S/C6H8F3NO/c7-6(8,9)4-2-1-3-5(10)11/h1,3H,2,4H2,(H2,10,11)/b3-1-.
What are the key properties of (Z)-6,6,6-trifluorohex-2-enamide?
(Z)-6,6,6-trifluorohex-2-enamide has a molecular weight of 167.13 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6,6,6-trifluorohex-2-enamide is sourced from PubChem (CID 55266504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).