[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine

C16H23F3N2 — CID 105326392

IUPAC[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCCc1cccc(C(NN)C2CCCCC2C(F)(F)F)c1
InChIInChI=1S/C16H23F3N2/c1-2-11-6-5-7-12(10-11)15(21-20)13-8-3-4-9-14(13)16(17,18)19/h5-7,10,13-15,21H,2-4,8-9,20H2,1H3
InChIKeyNUILBTZBVHQGEX-UHFFFAOYSA-N
MW300.37 g/mol
LogP4.12
Rot. Bonds4

About [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine

[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine (PubChem CID 105326392) has the molecular formula C16H23F3N2 and a molecular weight of 300.37 g/mol. Its IUPAC name is [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine
PubChem CID105326392
Molecular FormulaC16H23F3N2
Molecular Weight300.37 g/mol
Exact Mass300.18
IUPAC Name[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCCc1cccc(C(NN)C2CCCCC2C(F)(F)F)c1
InChIInChI=1S/C16H23F3N2/c1-2-11-6-5-7-12(10-11)15(21-20)13-8-3-4-9-14(13)16(17,18)19/h5-7,10,13-15,21H,2-4,8-9,20H2,1H3
InChIKeyNUILBTZBVHQGEX-UHFFFAOYSA-N
XLogP4.12
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 54.12
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-ethylphenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232166
[cyclopentyl-(3-propylphenyl)methyl]hydrazine
CID 105204459
N-methyl-1-(3-methylphenyl)-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105090899
[2-cyclopropyl-1-(3-ethylphenyl)propyl]hydrazine
CID 105326261
[2-chloro-1-(3-ethylphenyl)-2,2-difluoroethyl]hydrazine
CID 105265335
N-[phenyl-[2-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 105084116
[2-cyclopropyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105253991
[2-cyclohexylsulfanyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105227705
2-cycloheptyl-1-(3-ethylphenyl)-N-methylethanamine
CID 105018546
(R)-cyclopropyl-(3-ethylphenyl)methanamine
CID 55277646
(S)-cyclopropyl-(3-ethylphenyl)methanamine
CID 131196510
1-(3,4-dimethylphenyl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105140403

Frequently Asked Questions

What is the IUPAC name of [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The IUPAC name of [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine (CID 105326392) is [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine.
What is the SMILES notation for [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The canonical SMILES for [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine is CCc1cccc(C(NN)C2CCCCC2C(F)(F)F)c1.
What is the InChIKey of [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The InChIKey is NUILBTZBVHQGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F3N2/c1-2-11-6-5-7-12(10-11)15(21-20)13-8-3-4-9-14(13)16(17,18)19/h5-7,10,13-15,21H,2-4,8-9,20H2,1H3.
What are the key properties of [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
[(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine has a molecular weight of 300.37 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethylphenyl)-[2-(trifluoromethyl)cyclohexyl]methyl]hydrazine is sourced from PubChem (CID 105326392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).