(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine

C7H12FN — CID 129210143

IUPAC(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine
SMILESC/C=C(\C=C/CF)CN
InChIInChI=1S/C7H12FN/c1-2-7(6-9)4-3-5-8/h2-4H,5-6,9H2,1H3/b4-3-,7-2+
InChIKeyWTYCJOZVJHEDAM-HTQYPNKRSA-N
MW129.18 g/mol
LogP1.42
Rot. Bonds3

About (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine

(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine (PubChem CID 129210143) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine
PubChem CID129210143
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine
SMILESC/C=C(\C=C/CF)CN
InChIInChI=1S/C7H12FN/c1-2-7(6-9)4-3-5-8/h2-4H,5-6,9H2,1H3/b4-3-,7-2+
InChIKeyWTYCJOZVJHEDAM-HTQYPNKRSA-N
XLogP1.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine?
The IUPAC name of (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine (CID 129210143) is (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine?
The canonical SMILES for (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine is C/C=C(\C=C/CF)CN.
What is the InChIKey of (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine?
The InChIKey is WTYCJOZVJHEDAM-HTQYPNKRSA-N. The full InChI is InChI=1S/C7H12FN/c1-2-7(6-9)4-3-5-8/h2-4H,5-6,9H2,1H3/b4-3-,7-2+.
What are the key properties of (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine?
(Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine has a molecular weight of 129.18 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-2-ethylidene-5-fluoropent-3-en-1-amine is sourced from PubChem (CID 129210143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).