[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine

C14H22ClFN2 — CID 105398110

IUPAC[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine
SMILESCCCCC(CC)C(NN)c1cc(F)ccc1Cl
InChIInChI=1S/C14H22ClFN2/c1-3-5-6-10(4-2)14(18-17)12-9-11(16)7-8-13(12)15/h7-10,14,18H,3-6,17H2,1-2H3
InChIKeyYMIYPQFEJYMUGO-UHFFFAOYSA-N
MW272.79 g/mol
LogP4.20
Rot. Bonds7

About [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine

[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine (PubChem CID 105398110) has the molecular formula C14H22ClFN2 and a molecular weight of 272.79 g/mol. Its IUPAC name is [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine
PubChem CID105398110
Molecular FormulaC14H22ClFN2
Molecular Weight272.79 g/mol
Exact Mass272.15
IUPAC Name[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine
SMILESCCCCC(CC)C(NN)c1cc(F)ccc1Cl
InChIInChI=1S/C14H22ClFN2/c1-3-5-6-10(4-2)14(18-17)12-9-11(16)7-8-13(12)15/h7-10,14,18H,3-6,17H2,1-2H3
InChIKeyYMIYPQFEJYMUGO-UHFFFAOYSA-N
XLogP4.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.79
LogP ≤ 54.20
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-5-fluorophenyl)-2-ethyl-N-methylbutan-1-amine
CID 105397290
1-(2-chloro-5-fluorophenyl)heptylhydrazine
CID 105398143
[1-(2-chloro-5-fluorophenyl)-2-ethoxypentyl]hydrazine
CID 105397975
1-(2-chloro-5-fluorophenyl)-N,3-diethylheptan-2-amine
CID 102622959
1-(2,4-difluorophenyl)-N,2-diethylhexan-1-amine
CID 43491010
[2-ethyl-1-(2-methylphenyl)hexyl]hydrazine
CID 105286043
1-(2-chloro-5-fluorophenyl)-2-ethylbutan-1-amine
CID 105397485
[2-ethyl-1-[2-(trifluoromethyl)phenyl]hexyl]hydrazine
CID 105304814
1-(3,4-dichlorophenyl)-2-ethyl-N-methylhexan-1-amine
CID 43486466
1-(2-chloro-5-fluorophenyl)-2-methyl-N-propylbutan-1-amine
CID 105394946
2-chloro-5-fluoro-N-heptan-3-ylaniline
CID 107527238
[1-(2-bromo-4-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
CID 105296661

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine?
The IUPAC name of [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine (CID 105398110) is [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine?
The canonical SMILES for [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine is CCCCC(CC)C(NN)c1cc(F)ccc1Cl.
What is the InChIKey of [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine?
The InChIKey is YMIYPQFEJYMUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClFN2/c1-3-5-6-10(4-2)14(18-17)12-9-11(16)7-8-13(12)15/h7-10,14,18H,3-6,17H2,1-2H3.
What are the key properties of [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine?
[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine has a molecular weight of 272.79 g/mol, XLogP of 4.20, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine is sourced from PubChem (CID 105398110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).