1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine

C12H16ClFN2 — CID 105280013

IUPAC1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1cc(Cl)ccc1F
InChIInChI=1S/C12H16ClFN2/c1-2-3-4-5-12(16-15)10-8-9(13)6-7-11(10)14/h2,6-8,12,16H,1,3-5,15H2
InChIKeyQXCULKHCFZFLGA-UHFFFAOYSA-N
MW242.72 g/mol
LogP3.34
Rot. Bonds6

About 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine

1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine (PubChem CID 105280013) has the molecular formula C12H16ClFN2 and a molecular weight of 242.72 g/mol. Its IUPAC name is 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine.

Molecular Properties

Compound Name1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
PubChem CID105280013
Molecular FormulaC12H16ClFN2
Molecular Weight242.72 g/mol
Exact Mass242.10
IUPAC Name1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1cc(Cl)ccc1F
InChIInChI=1S/C12H16ClFN2/c1-2-3-4-5-12(16-15)10-8-9(13)6-7-11(10)14/h2,6-8,12,16H,1,3-5,15H2
InChIKeyQXCULKHCFZFLGA-UHFFFAOYSA-N
XLogP3.34
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.72
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(5-chloro-2-methylphenyl)hex-5-enylhydrazine
CID 105311435
1-(3-chloro-4-fluorophenyl)hex-5-enylhydrazine
CID 105218048
1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
CID 107997433
1-(2-bromo-3,4-difluorophenyl)hex-5-enylhydrazine
CID 107541153
1-(2-fluoro-5-methylphenyl)pent-4-enylhydrazine
CID 105311474
[1-(5-chloro-2-fluorophenyl)-4-phenylbutyl]hydrazine
CID 105279983
[1-(5-chloro-2-fluorophenyl)-4-methylpent-4-enyl]hydrazine
CID 105280086
[1-(5-chloro-2-fluorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105280162
1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
CID 107970721
1-(2,4-dibromophenyl)hex-5-enylhydrazine
CID 107948272
1-(3-chloro-4-fluorophenyl)pent-4-enylhydrazine
CID 105218132
1-(2-chloro-4-fluorophenyl)pent-4-enylhydrazine
CID 105215376

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine?
The IUPAC name of 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine (CID 105280013) is 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine.
What is the SMILES notation for 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine?
The canonical SMILES for 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine is C=CCCCC(NN)c1cc(Cl)ccc1F.
What is the InChIKey of 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine?
The InChIKey is QXCULKHCFZFLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClFN2/c1-2-3-4-5-12(16-15)10-8-9(13)6-7-11(10)14/h2,6-8,12,16H,1,3-5,15H2.
What are the key properties of 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine?
1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine has a molecular weight of 242.72 g/mol, XLogP of 3.34, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine is sourced from PubChem (CID 105280013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).