[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

C16H23F3N2 — CID 105312456

IUPAC[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCC1CCC(C(NN)c2ccccc2C(F)(F)F)CC1C
InChIInChI=1S/C16H23F3N2/c1-10-7-8-12(9-11(10)2)15(21-20)13-5-3-4-6-14(13)16(17,18)19/h3-6,10-12,15,21H,7-9,20H2,1-2H3
InChIKeyOHJZFAXCLJAFPP-UHFFFAOYSA-N
MW300.37 g/mol
LogP4.28
Rot. Bonds3

About [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105312456) has the molecular formula C16H23F3N2 and a molecular weight of 300.37 g/mol. Its IUPAC name is [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105312456
Molecular FormulaC16H23F3N2
Molecular Weight300.37 g/mol
Exact Mass300.18
IUPAC Name[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCC1CCC(C(NN)c2ccccc2C(F)(F)F)CC1C
InChIInChI=1S/C16H23F3N2/c1-10-7-8-12(9-11(10)2)15(21-20)13-5-3-4-6-14(13)16(17,18)19/h3-6,10-12,15,21H,7-9,20H2,1-2H3
InChIKeyOHJZFAXCLJAFPP-UHFFFAOYSA-N
XLogP4.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 54.28
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

[(3-bromo-2-methylphenyl)-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105312464
[(2,2-dimethylcyclopropyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107005670
1-(3-ethylcyclopentyl)-N-methyl-1-[2-(trifluoromethyl)phenyl]methanamine
CID 65411611
[(3,4-dimethylcyclohexyl)-thiophen-2-ylmethyl]hydrazine
CID 105193681
[(5-chloro-2-methylphenyl)-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105312511
[[4-bromo-2-(trifluoromethyl)phenyl]-cyclopropylmethyl]hydrazine
CID 105212772
[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105299132
N-[(2-methylcyclopropyl)-[2-(trifluoromethyl)phenyl]methyl]propan-1-amine
CID 65420429
N-(dicyclopropylmethyl)-1-[2-(trifluoromethyl)phenyl]ethanamine
CID 43111630
N-[cyclobutyl-[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 64986342
[2,3-dihydro-1,4-benzodioxin-6-yl-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105312385
1-(3,4-dimethylcyclohexyl)-1-(2-fluoro-3-methylphenyl)-N-methylmethanamine
CID 104989351

Frequently Asked Questions

What is the IUPAC name of [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105312456) is [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is CC1CCC(C(NN)c2ccccc2C(F)(F)F)CC1C.
What is the InChIKey of [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is OHJZFAXCLJAFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F3N2/c1-10-7-8-12(9-11(10)2)15(21-20)13-5-3-4-6-14(13)16(17,18)19/h3-6,10-12,15,21H,7-9,20H2,1-2H3.
What are the key properties of [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
[(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 300.37 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-dimethylcyclohexyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105312456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).