[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine

C16H17F3N2 — CID 105300140

IUPAC[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(C(F)(F)F)cc2)cc1C
InChIInChI=1S/C16H17F3N2/c1-10-3-4-13(9-11(10)2)15(21-20)12-5-7-14(8-6-12)16(17,18)19/h3-9,15,21H,20H2,1-2H3
InChIKeyKQLHKVDAQCNDGK-UHFFFAOYSA-N
MW294.32 g/mol
LogP3.87
Rot. Bonds3

About [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine

[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105300140) has the molecular formula C16H17F3N2 and a molecular weight of 294.32 g/mol. Its IUPAC name is [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105300140
Molecular FormulaC16H17F3N2
Molecular Weight294.32 g/mol
Exact Mass294.13
IUPAC Name[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(C(F)(F)F)cc2)cc1C
InChIInChI=1S/C16H17F3N2/c1-10-3-4-13(9-11(10)2)15(21-20)12-5-7-14(8-6-12)16(17,18)19/h3-9,15,21H,20H2,1-2H3
InChIKeyKQLHKVDAQCNDGK-UHFFFAOYSA-N
XLogP3.87
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 53.87
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'}

Analyze [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(4-chloro-3-methylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105302305
bis(3,4-dimethylphenyl)methylhydrazine
CID 105300164
[(2,5-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105292454
[(3,4-dimethylphenyl)-pyridin-4-ylmethyl]hydrazine
CID 105196557
[(2-methyl-4-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 106756526
[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301346
[(4-tert-butylphenyl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 105300392
[(3,4-dimethylphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105193094
[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
CID 105261045
[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
CID 102759413
[(2-chloro-4-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105252881
[(3,4-dimethylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710524

Frequently Asked Questions

What is the IUPAC name of [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105300140) is [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1ccc(C(NN)c2ccc(C(F)(F)F)cc2)cc1C.
What is the InChIKey of [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is KQLHKVDAQCNDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F3N2/c1-10-3-4-13(9-11(10)2)15(21-20)12-5-7-14(8-6-12)16(17,18)19/h3-9,15,21H,20H2,1-2H3.
What are the key properties of [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 294.32 g/mol, XLogP of 3.87, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105300140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).