(Z)-5,5,5-trifluoropent-2-en-1-imine

C5H6F3N — CID 143881944

IUPAC(Z)-5,5,5-trifluoropent-2-en-1-imine
SMILES[H]/N=C/C=C\CC(F)(F)F
InChIInChI=1S/C5H6F3N/c6-5(7,8)3-1-2-4-9/h1-2,4,9H,3H2/b2-1-,9-4+
InChIKeyYEVCAUHTRAXYQI-GMOBHNBPSA-N
MW137.10 g/mol
LogP2.14
Rot. Bonds2

About (Z)-5,5,5-trifluoropent-2-en-1-imine

(Z)-5,5,5-trifluoropent-2-en-1-imine (PubChem CID 143881944) has the molecular formula C5H6F3N and a molecular weight of 137.10 g/mol. Its IUPAC name is (Z)-5,5,5-trifluoropent-2-en-1-imine.

Molecular Properties

Compound Name(Z)-5,5,5-trifluoropent-2-en-1-imine
PubChem CID143881944
Molecular FormulaC5H6F3N
Molecular Weight137.10 g/mol
Exact Mass137.05
IUPAC Name(Z)-5,5,5-trifluoropent-2-en-1-imine
SMILES[H]/N=C/C=C\CC(F)(F)F
InChIInChI=1S/C5H6F3N/c6-5(7,8)3-1-2-4-9/h1-2,4,9H,3H2/b2-1-,9-4+
InChIKeyYEVCAUHTRAXYQI-GMOBHNBPSA-N
XLogP2.14
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.10
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-5,5,5-trifluoropent-2-en-1-imine?
The IUPAC name of (Z)-5,5,5-trifluoropent-2-en-1-imine (CID 143881944) is (Z)-5,5,5-trifluoropent-2-en-1-imine.
What is the SMILES notation for (Z)-5,5,5-trifluoropent-2-en-1-imine?
The canonical SMILES for (Z)-5,5,5-trifluoropent-2-en-1-imine is [H]/N=C/C=C\CC(F)(F)F.
What is the InChIKey of (Z)-5,5,5-trifluoropent-2-en-1-imine?
The InChIKey is YEVCAUHTRAXYQI-GMOBHNBPSA-N. The full InChI is InChI=1S/C5H6F3N/c6-5(7,8)3-1-2-4-9/h1-2,4,9H,3H2/b2-1-,9-4+.
What are the key properties of (Z)-5,5,5-trifluoropent-2-en-1-imine?
(Z)-5,5,5-trifluoropent-2-en-1-imine has a molecular weight of 137.10 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5,5,5-trifluoropent-2-en-1-imine is sourced from PubChem (CID 143881944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).