(E)-5-fluoropent-2-ene-1,4-diamine

C5H11FN2 — CID 6439606

IUPAC(E)-5-fluoropent-2-ene-1,4-diamine
SMILESNC/C=C/C(N)CF
InChIInChI=1S/C5H11FN2/c6-4-5(8)2-1-3-7/h1-2,5H,3-4,7-8H2/b2-1+
InChIKeyWHCJZNLLRJRMHI-OWOJBTEDSA-N
MW118.15 g/mol
LogP-0.20
Rot. Bonds3

About (E)-5-fluoropent-2-ene-1,4-diamine

(E)-5-fluoropent-2-ene-1,4-diamine (PubChem CID 6439606) has the molecular formula C5H11FN2 and a molecular weight of 118.15 g/mol. Its IUPAC name is (E)-5-fluoropent-2-ene-1,4-diamine.

Molecular Properties

Compound Name(E)-5-fluoropent-2-ene-1,4-diamine
PubChem CID6439606
Molecular FormulaC5H11FN2
Molecular Weight118.15 g/mol
Exact Mass118.09
IUPAC Name(E)-5-fluoropent-2-ene-1,4-diamine
SMILESNC/C=C/C(N)CF
InChIInChI=1S/C5H11FN2/c6-4-5(8)2-1-3-7/h1-2,5H,3-4,7-8H2/b2-1+
InChIKeyWHCJZNLLRJRMHI-OWOJBTEDSA-N
XLogP-0.20
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.15
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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)-5-fluoropent-2-ene-1,4-diamine?
The IUPAC name of (E)-5-fluoropent-2-ene-1,4-diamine (CID 6439606) is (E)-5-fluoropent-2-ene-1,4-diamine.
What is the SMILES notation for (E)-5-fluoropent-2-ene-1,4-diamine?
The canonical SMILES for (E)-5-fluoropent-2-ene-1,4-diamine is NC/C=C/C(N)CF.
What is the InChIKey of (E)-5-fluoropent-2-ene-1,4-diamine?
The InChIKey is WHCJZNLLRJRMHI-OWOJBTEDSA-N. The full InChI is InChI=1S/C5H11FN2/c6-4-5(8)2-1-3-7/h1-2,5H,3-4,7-8H2/b2-1+.
What are the key properties of (E)-5-fluoropent-2-ene-1,4-diamine?
(E)-5-fluoropent-2-ene-1,4-diamine has a molecular weight of 118.15 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-fluoropent-2-ene-1,4-diamine is sourced from PubChem (CID 6439606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).