(E)-4-fluoropent-3-en-2-imine

C5H8FN — CID 123517635

IUPAC(E)-4-fluoropent-3-en-2-imine
SMILES[H]/N=C(C)/C=C(\C)F
InChIInChI=1S/C5H8FN/c1-4(6)3-5(2)7/h3,7H,1-2H3/b4-3+,7-5+
InChIKeyGKPLKFNQYJSVTO-BDWKERMESA-N
MW101.12 g/mol
LogP1.90
Rot. Bonds1

About (E)-4-fluoropent-3-en-2-imine

(E)-4-fluoropent-3-en-2-imine (PubChem CID 123517635) has the molecular formula C5H8FN and a molecular weight of 101.12 g/mol. Its IUPAC name is (E)-4-fluoropent-3-en-2-imine.

Molecular Properties

Compound Name(E)-4-fluoropent-3-en-2-imine
PubChem CID123517635
Molecular FormulaC5H8FN
Molecular Weight101.12 g/mol
Exact Mass101.06
IUPAC Name(E)-4-fluoropent-3-en-2-imine
SMILES[H]/N=C(C)/C=C(\C)F
InChIInChI=1S/C5H8FN/c1-4(6)3-5(2)7/h3,7H,1-2H3/b4-3+,7-5+
InChIKeyGKPLKFNQYJSVTO-BDWKERMESA-N
XLogP1.90
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.12
LogP ≤ 51.90
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

(E)-1,5-difluoro-3-methylpent-3-en-2-imine
CID 134932492
(E)-1,5-difluoropent-3-en-2-imine
CID 134933350
2,6-Dimethylhepta-2,5-dien-4-imine
CID 23064947
4-Fluorohex-4-en-3-imine
CID 91259833
(4E)-4-fluorohepta-1,4-dien-3-imine
CID 91304230
(E)-5-fluorohex-4-en-3-imine
CID 91325186
(3E)-3-fluoro-5-methylhexa-3,5-dien-2-imine
CID 91342165
(3Z)-5-fluorohexa-3,5-dien-2-imine
CID 91396866
(E)-4-fluorohex-4-en-3-imine
CID 91480472
(3Z)-5-fluoro-3-methylhexa-3,5-dien-2-imine
CID 91576140
(3E,5E)-3,5-difluorohepta-3,5-dien-2-imine
CID 117718963
1,1,1-Trifluoro-4-methylpent-3-en-2-imine
CID 118281607

Frequently Asked Questions

What is the IUPAC name of (E)-4-fluoropent-3-en-2-imine?
The IUPAC name of (E)-4-fluoropent-3-en-2-imine (CID 123517635) is (E)-4-fluoropent-3-en-2-imine.
What is the SMILES notation for (E)-4-fluoropent-3-en-2-imine?
The canonical SMILES for (E)-4-fluoropent-3-en-2-imine is [H]/N=C(C)/C=C(\C)F.
What is the InChIKey of (E)-4-fluoropent-3-en-2-imine?
The InChIKey is GKPLKFNQYJSVTO-BDWKERMESA-N. The full InChI is InChI=1S/C5H8FN/c1-4(6)3-5(2)7/h3,7H,1-2H3/b4-3+,7-5+.
What are the key properties of (E)-4-fluoropent-3-en-2-imine?
(E)-4-fluoropent-3-en-2-imine has a molecular weight of 101.12 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-fluoropent-3-en-2-imine is sourced from PubChem (CID 123517635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).