(E)-1,5-difluoropent-3-en-2-imine

C5H7F2N — CID 134933350

IUPAC(E)-1,5-difluoropent-3-en-2-imine
SMILES[H]/N=C(/C=C/CF)CF
InChIInChI=1S/C5H7F2N/c6-3-1-2-5(8)4-7/h1-2,8H,3-4H2/b2-1+,8-5-
InChIKeyYZCQFVBJQFNYNO-VTCCBETESA-N
MW119.11 g/mol
LogP1.50
Rot. Bonds3

About (E)-1,5-difluoropent-3-en-2-imine

(E)-1,5-difluoropent-3-en-2-imine (PubChem CID 134933350) has the molecular formula C5H7F2N and a molecular weight of 119.11 g/mol. Its IUPAC name is (E)-1,5-difluoropent-3-en-2-imine.

Molecular Properties

Compound Name(E)-1,5-difluoropent-3-en-2-imine
PubChem CID134933350
Molecular FormulaC5H7F2N
Molecular Weight119.11 g/mol
Exact Mass119.05
IUPAC Name(E)-1,5-difluoropent-3-en-2-imine
SMILES[H]/N=C(/C=C/CF)CF
InChIInChI=1S/C5H7F2N/c6-3-1-2-5(8)4-7/h1-2,8H,3-4H2/b2-1+,8-5-
InChIKeyYZCQFVBJQFNYNO-VTCCBETESA-N
XLogP1.50
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.11
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3E)-5-fluoro-2-methylpenta-1,3-diene
CID 54095887
6-iminoocta-2,4-dienal
CID 142648191
(Z)-hept-3-ene-2,5-diimine
CID 143456495
(3Z,5Z)-7-fluoro-4-methylhepta-1,3,5-triene
CID 118002257
(Z)-6-methylhept-2-en-4-imine
CID 91390862
ethane;(2Z,4Z,6Z)-1-fluoro-5-methylocta-2,4,6-trien-4-ol
CID 143613129
(2Z,4Z)-1-fluoro-4-propylhepta-2,4-diene
CID 143996817
pent-2-enimidamide
CID 74821450
(Z)-4-iminobut-2-enimidoyl fluoride
CID 146392552
(E)-5-methylhept-4-en-3-imine
CID 123846053
(3Z,5Z)-7-fluorohepta-1,3,5-triene-2-thiol
CID 155374240
(E)-3,3-difluoro-2-methanimidoylprop-1-en-1-amine
CID 170964623

Frequently Asked Questions

What is the IUPAC name of (E)-1,5-difluoropent-3-en-2-imine?
The IUPAC name of (E)-1,5-difluoropent-3-en-2-imine (CID 134933350) is (E)-1,5-difluoropent-3-en-2-imine.
What is the SMILES notation for (E)-1,5-difluoropent-3-en-2-imine?
The canonical SMILES for (E)-1,5-difluoropent-3-en-2-imine is [H]/N=C(/C=C/CF)CF.
What is the InChIKey of (E)-1,5-difluoropent-3-en-2-imine?
The InChIKey is YZCQFVBJQFNYNO-VTCCBETESA-N. The full InChI is InChI=1S/C5H7F2N/c6-3-1-2-5(8)4-7/h1-2,8H,3-4H2/b2-1+,8-5-.
What are the key properties of (E)-1,5-difluoropent-3-en-2-imine?
(E)-1,5-difluoropent-3-en-2-imine has a molecular weight of 119.11 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,5-difluoropent-3-en-2-imine is sourced from PubChem (CID 134933350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).