1-(2-chloro-5-fluorophenyl)heptylhydrazine

C13H20ClFN2 — CID 105398143

IUPAC1-(2-chloro-5-fluorophenyl)heptylhydrazine
SMILESCCCCCCC(NN)c1cc(F)ccc1Cl
InChIInChI=1S/C13H20ClFN2/c1-2-3-4-5-6-13(17-16)11-9-10(15)7-8-12(11)14/h7-9,13,17H,2-6,16H2,1H3
InChIKeyGJPHLIOOMHQMNX-UHFFFAOYSA-N
MW258.77 g/mol
LogP3.95
Rot. Bonds7

About 1-(2-chloro-5-fluorophenyl)heptylhydrazine

1-(2-chloro-5-fluorophenyl)heptylhydrazine (PubChem CID 105398143) has the molecular formula C13H20ClFN2 and a molecular weight of 258.77 g/mol. Its IUPAC name is 1-(2-chloro-5-fluorophenyl)heptylhydrazine.

Molecular Properties

Compound Name1-(2-chloro-5-fluorophenyl)heptylhydrazine
PubChem CID105398143
Molecular FormulaC13H20ClFN2
Molecular Weight258.77 g/mol
Exact Mass258.13
IUPAC Name1-(2-chloro-5-fluorophenyl)heptylhydrazine
SMILESCCCCCCC(NN)c1cc(F)ccc1Cl
InChIInChI=1S/C13H20ClFN2/c1-2-3-4-5-6-13(17-16)11-9-10(15)7-8-12(11)14/h7-9,13,17H,2-6,16H2,1H3
InChIKeyGJPHLIOOMHQMNX-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.77
LogP ≤ 53.95
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-fluoro-2-(1-hydrazinylundecyl)aniline
CID 105263337
4-fluoro-2-(1-hydrazinyldecyl)aniline
CID 105263176
1-(2,4-dichlorophenyl)heptylhydrazine
CID 105293920
1-(4-fluorophenyl)undecylhydrazine
CID 105192861
1-(3-chloro-4-fluorophenyl)decylhydrazine
CID 105218123
[1-(2-chloro-5-fluorophenyl)-3,3-dimethylbutyl]hydrazine
CID 105397818
[1-(2-chloro-5-fluorophenyl)-2-ethylhexyl]hydrazine
CID 105398110
[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine
CID 105398187
1-(2-fluorophenyl)dodecylhydrazine
CID 105292285
1-(2,5-dichlorophenyl)-N-methylnonan-1-amine
CID 65449520
1-(2,5-dichlorophenyl)-N-methyldecan-1-amine
CID 65449519
[1-(2-chloro-5-fluorophenyl)-3-(2-methylphenyl)propyl]hydrazine
CID 105398184

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-fluorophenyl)heptylhydrazine?
The IUPAC name of 1-(2-chloro-5-fluorophenyl)heptylhydrazine (CID 105398143) is 1-(2-chloro-5-fluorophenyl)heptylhydrazine.
What is the SMILES notation for 1-(2-chloro-5-fluorophenyl)heptylhydrazine?
The canonical SMILES for 1-(2-chloro-5-fluorophenyl)heptylhydrazine is CCCCCCC(NN)c1cc(F)ccc1Cl.
What is the InChIKey of 1-(2-chloro-5-fluorophenyl)heptylhydrazine?
The InChIKey is GJPHLIOOMHQMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClFN2/c1-2-3-4-5-6-13(17-16)11-9-10(15)7-8-12(11)14/h7-9,13,17H,2-6,16H2,1H3.
What are the key properties of 1-(2-chloro-5-fluorophenyl)heptylhydrazine?
1-(2-chloro-5-fluorophenyl)heptylhydrazine has a molecular weight of 258.77 g/mol, XLogP of 3.95, 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)heptylhydrazine is sourced from PubChem (CID 105398143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).