1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine

C13H20F2N2 — CID 166651400

IUPAC1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine
SMILESC=CCC(=C)N(CC(=C)/C(F)=C(\C)F)N(C)C
InChIInChI=1S/C13H20F2N2/c1-7-8-11(3)17(16(5)6)9-10(2)13(15)12(4)14/h7H,1-3,8-9H2,4-6H3/b13-12-
InChIKeyBAHLZRBGYFIJSE-SEYXRHQNSA-N
MW242.31 g/mol
LogP3.58
Rot. Bonds7

About 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine

1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine (PubChem CID 166651400) has the molecular formula C13H20F2N2 and a molecular weight of 242.31 g/mol. Its IUPAC name is 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine.

Molecular Properties

Compound Name1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine
PubChem CID166651400
Molecular FormulaC13H20F2N2
Molecular Weight242.31 g/mol
Exact Mass242.16
IUPAC Name1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine
SMILESC=CCC(=C)N(CC(=C)/C(F)=C(\C)F)N(C)C
InChIInChI=1S/C13H20F2N2/c1-7-8-11(3)17(16(5)6)9-10(2)13(15)12(4)14/h7H,1-3,8-9H2,4-6H3/b13-12-
InChIKeyBAHLZRBGYFIJSE-SEYXRHQNSA-N
XLogP3.58
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine?
The IUPAC name of 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine (CID 166651400) is 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine.
What is the SMILES notation for 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine?
The canonical SMILES for 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine is C=CCC(=C)N(CC(=C)/C(F)=C(\C)F)N(C)C.
What is the InChIKey of 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine?
The InChIKey is BAHLZRBGYFIJSE-SEYXRHQNSA-N. The full InChI is InChI=1S/C13H20F2N2/c1-7-8-11(3)17(16(5)6)9-10(2)13(15)12(4)14/h7H,1-3,8-9H2,4-6H3/b13-12-.
What are the key properties of 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine?
1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine has a molecular weight of 242.31 g/mol, XLogP of 3.58, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-3,4-difluoro-2-methylidenepent-3-enyl]-2,2-dimethyl-1-penta-1,4-dien-2-ylhydrazine is sourced from PubChem (CID 166651400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).