(E)-2-ethenyl-5-fluorohex-4-en-1-amine

C8H14FN — CID 143973192

IUPAC(E)-2-ethenyl-5-fluorohex-4-en-1-amine
SMILESC=CC(CN)C/C=C(\C)F
InChIInChI=1S/C8H14FN/c1-3-8(6-10)5-4-7(2)9/h3-4,8H,1,5-6,10H2,2H3/b7-4+
InChIKeyBIZJHBYXODKEEO-QPJJXVBHSA-N
MW143.20 g/mol
LogP2.01
Rot. Bonds4

About (E)-2-ethenyl-5-fluorohex-4-en-1-amine

(E)-2-ethenyl-5-fluorohex-4-en-1-amine (PubChem CID 143973192) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (E)-2-ethenyl-5-fluorohex-4-en-1-amine.

Molecular Properties

Compound Name(E)-2-ethenyl-5-fluorohex-4-en-1-amine
PubChem CID143973192
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(E)-2-ethenyl-5-fluorohex-4-en-1-amine
SMILESC=CC(CN)C/C=C(\C)F
InChIInChI=1S/C8H14FN/c1-3-8(6-10)5-4-7(2)9/h3-4,8H,1,5-6,10H2,2H3/b7-4+
InChIKeyBIZJHBYXODKEEO-QPJJXVBHSA-N
XLogP2.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-2-ethenyl-5-fluorohex-4-en-1-amine?
The IUPAC name of (E)-2-ethenyl-5-fluorohex-4-en-1-amine (CID 143973192) is (E)-2-ethenyl-5-fluorohex-4-en-1-amine.
What is the SMILES notation for (E)-2-ethenyl-5-fluorohex-4-en-1-amine?
The canonical SMILES for (E)-2-ethenyl-5-fluorohex-4-en-1-amine is C=CC(CN)C/C=C(\C)F.
What is the InChIKey of (E)-2-ethenyl-5-fluorohex-4-en-1-amine?
The InChIKey is BIZJHBYXODKEEO-QPJJXVBHSA-N. The full InChI is InChI=1S/C8H14FN/c1-3-8(6-10)5-4-7(2)9/h3-4,8H,1,5-6,10H2,2H3/b7-4+.
What are the key properties of (E)-2-ethenyl-5-fluorohex-4-en-1-amine?
(E)-2-ethenyl-5-fluorohex-4-en-1-amine has a molecular weight of 143.20 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-ethenyl-5-fluorohex-4-en-1-amine is sourced from PubChem (CID 143973192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).