1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine

C6H11FN2 — CID 146325910

IUPAC1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine
SMILESC=C(F)/C=C(\C)NNC
InChIInChI=1S/C6H11FN2/c1-5(7)4-6(2)9-8-3/h4,8-9H,1H2,2-3H3/b6-4+
InChIKeyXHPYUPGMHLHIAN-GQCTYLIASA-N
MW130.17 g/mol
LogP1.10
Rot. Bonds3

About 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine

1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine (PubChem CID 146325910) has the molecular formula C6H11FN2 and a molecular weight of 130.17 g/mol. Its IUPAC name is 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine.

Molecular Properties

Compound Name1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine
PubChem CID146325910
Molecular FormulaC6H11FN2
Molecular Weight130.17 g/mol
Exact Mass130.09
IUPAC Name1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine
SMILESC=C(F)/C=C(\C)NNC
InChIInChI=1S/C6H11FN2/c1-5(7)4-6(2)9-8-3/h4,8-9H,1H2,2-3H3/b6-4+
InChIKeyXHPYUPGMHLHIAN-GQCTYLIASA-N
XLogP1.10
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine?
The IUPAC name of 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine (CID 146325910) is 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine.
What is the SMILES notation for 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine?
The canonical SMILES for 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine is C=C(F)/C=C(\C)NNC.
What is the InChIKey of 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine?
The InChIKey is XHPYUPGMHLHIAN-GQCTYLIASA-N. The full InChI is InChI=1S/C6H11FN2/c1-5(7)4-6(2)9-8-3/h4,8-9H,1H2,2-3H3/b6-4+.
What are the key properties of 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine?
1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine has a molecular weight of 130.17 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2E)-4-fluoropenta-2,4-dien-2-yl]-2-methylhydrazine is sourced from PubChem (CID 146325910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).