[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

C15H14ClF3N2 — CID 105301346

IUPAC[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(C(NN)c2cccc(C(F)(F)F)c2)cc1Cl
InChIInChI=1S/C15H14ClF3N2/c1-9-5-6-11(8-13(9)16)14(21-20)10-3-2-4-12(7-10)15(17,18)19/h2-8,14,21H,20H2,1H3
InChIKeyKIUOJSUUTDTFEI-UHFFFAOYSA-N
MW314.74 g/mol
LogP4.22
Rot. Bonds3

About [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105301346) has the molecular formula C15H14ClF3N2 and a molecular weight of 314.74 g/mol. Its IUPAC name is [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105301346
Molecular FormulaC15H14ClF3N2
Molecular Weight314.74 g/mol
Exact Mass314.08
IUPAC Name[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(C(NN)c2cccc(C(F)(F)F)c2)cc1Cl
InChIInChI=1S/C15H14ClF3N2/c1-9-5-6-11(8-13(9)16)14(21-20)10-3-2-4-12(7-10)15(17,18)19/h2-8,14,21H,20H2,1H3
InChIKeyKIUOJSUUTDTFEI-UHFFFAOYSA-N
XLogP4.22
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.74
LogP ≤ 54.22
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

[(4-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105192836
[(4-tert-butylphenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 105300392
[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193954
[(3-chloro-4-methylphenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105304823
[(2,5-dimethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193884
[(4-chloro-3-methylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105302305
[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105300140
[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine
CID 107562687
3-chloro-4-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]aniline
CID 43107164
[(3-chloro-4-methylphenyl)-[3-(2-methylpropyl)phenyl]methyl]hydrazine
CID 105340693
[(3-bromo-5-chlorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948177
[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301358

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105301346) is [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1ccc(C(NN)c2cccc(C(F)(F)F)c2)cc1Cl.
What is the InChIKey of [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is KIUOJSUUTDTFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF3N2/c1-9-5-6-11(8-13(9)16)14(21-20)10-3-2-4-12(7-10)15(17,18)19/h2-8,14,21H,20H2,1H3.
What are the key properties of [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 314.74 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105301346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).