[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine

C12H18ClFN2 — CID 105215256

IUPAC[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)c1ccc(F)cc1Cl
InChIInChI=1S/C12H18ClFN2/c1-8(2)3-6-12(16-15)10-5-4-9(14)7-11(10)13/h4-5,7-8,12,16H,3,6,15H2,1-2H3
InChIKeyNWSUQWRSOSRNMJ-UHFFFAOYSA-N
MW244.74 g/mol
LogP3.42
Rot. Bonds5

About [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine

[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine (PubChem CID 105215256) has the molecular formula C12H18ClFN2 and a molecular weight of 244.74 g/mol. Its IUPAC name is [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine
PubChem CID105215256
Molecular FormulaC12H18ClFN2
Molecular Weight244.74 g/mol
Exact Mass244.11
IUPAC Name[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)c1ccc(F)cc1Cl
InChIInChI=1S/C12H18ClFN2/c1-8(2)3-6-12(16-15)10-5-4-9(14)7-11(10)13/h4-5,7-8,12,16H,3,6,15H2,1-2H3
InChIKeyNWSUQWRSOSRNMJ-UHFFFAOYSA-N
XLogP3.42
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.74
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-chloro-4-fluorophenyl)-N,4-dimethylpentan-1-amine
CID 62946027
[1-(5-fluoro-2-methylphenyl)-4-methylpentyl]hydrazine
CID 105207462
[1-(2,5-dichlorophenyl)-4-methylpentyl]hydrazine
CID 105207581
[1-(2-chloro-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105215437
1-(2-chloro-4-fluorophenyl)pent-4-enylhydrazine
CID 105215376
[1-(2-chloro-4-fluorophenyl)-3-phenylpropyl]hydrazine
CID 105215295
[2-(2-chloro-4-fluorophenyl)-1-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105295166
5-chloro-2-(1-hydrazinyl-4-methylpentyl)aniline
CID 105224018
[1-(2-chloro-4-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105215278
1-(2-chloro-4-fluorophenyl)-3-methylbutan-1-amine
CID 62945198
(1R)-1-(2-chloro-5-fluorophenyl)-4-methylpentan-1-amine
CID 171204639
1-(2-chloro-4-fluorophenyl)ethanamine
CID 18542888

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine?
The IUPAC name of [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine (CID 105215256) is [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine?
The canonical SMILES for [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine is CC(C)CCC(NN)c1ccc(F)cc1Cl.
What is the InChIKey of [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine?
The InChIKey is NWSUQWRSOSRNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClFN2/c1-8(2)3-6-12(16-15)10-5-4-9(14)7-11(10)13/h4-5,7-8,12,16H,3,6,15H2,1-2H3.
What are the key properties of [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine?
[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine has a molecular weight of 244.74 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine is sourced from PubChem (CID 105215256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).