[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine

C16H18ClFN2 — CID 105398187

IUPAC[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine
SMILESCc1ccc(CCC(NN)c2cc(F)ccc2Cl)cc1
InChIInChI=1S/C16H18ClFN2/c1-11-2-4-12(5-3-11)6-9-16(20-19)14-10-13(18)7-8-15(14)17/h2-5,7-8,10,16,20H,6,9,19H2,1H3
InChIKeyJGJJAGMIKXXYSX-UHFFFAOYSA-N
MW292.79 g/mol
LogP3.92
Rot. Bonds5

About [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine

[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine (PubChem CID 105398187) has the molecular formula C16H18ClFN2 and a molecular weight of 292.79 g/mol. Its IUPAC name is [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine
PubChem CID105398187
Molecular FormulaC16H18ClFN2
Molecular Weight292.79 g/mol
Exact Mass292.11
IUPAC Name[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine
SMILESCc1ccc(CCC(NN)c2cc(F)ccc2Cl)cc1
InChIInChI=1S/C16H18ClFN2/c1-11-2-4-12(5-3-11)6-9-16(20-19)14-10-13(18)7-8-15(14)17/h2-5,7-8,10,16,20H,6,9,19H2,1H3
InChIKeyJGJJAGMIKXXYSX-UHFFFAOYSA-N
XLogP3.92
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.79
LogP ≤ 53.92
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)-N-ethyl-3-(4-methylphenyl)propan-1-amine
CID 105397098
[1-(2-chloro-5-fluorophenyl)-3-(2-methylphenyl)propyl]hydrazine
CID 105398184
[1-(2-chloro-4-fluorophenyl)-3-phenylpropyl]hydrazine
CID 105215295
[1-(2,3-difluoro-4-methylphenyl)-3-(4-methylphenyl)propyl]hydrazine
CID 107516737
1-(2-chloro-5-fluorophenyl)heptylhydrazine
CID 105398143
[1-(2-chloro-5-fluorophenyl)-3,3-dimethylbutyl]hydrazine
CID 105397818
1-(2-chloro-5-fluorophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 105397498
[1-(2,5-difluorophenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105219321
1-(2-chloro-5-fluorophenyl)-N-ethyl-3-phenylpropan-1-amine
CID 105394782
[1-(2-fluoro-3-methoxyphenyl)-3-(4-methylphenyl)propyl]hydrazine
CID 105329271
1-(2,4-difluorophenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105143608
[1-(2-chloro-5-fluorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 103152085

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine?
The IUPAC name of [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine (CID 105398187) is [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine?
The canonical SMILES for [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine is Cc1ccc(CCC(NN)c2cc(F)ccc2Cl)cc1.
What is the InChIKey of [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine?
The InChIKey is JGJJAGMIKXXYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClFN2/c1-11-2-4-12(5-3-11)6-9-16(20-19)14-10-13(18)7-8-15(14)17/h2-5,7-8,10,16,20H,6,9,19H2,1H3.
What are the key properties of [1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine?
[1-(2-chloro-5-fluorophenyl)-3-(4-methylphenyl)propyl]hydrazine has a molecular weight of 292.79 g/mol, XLogP of 3.92, 5 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)-3-(4-methylphenyl)propyl]hydrazine is sourced from PubChem (CID 105398187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).