[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine

C13H21F3N4 — CID 105307255

IUPAC[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCCn1nccc1C(NN)C1CCCC(C(F)(F)F)C1
InChIInChI=1S/C13H21F3N4/c1-2-20-11(6-7-18-20)12(19-17)9-4-3-5-10(8-9)13(14,15)16/h6-7,9-10,12,19H,2-5,8,17H2,1H3
InChIKeyWTKOZCMTECMPPL-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.78
Rot. Bonds4

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

[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine (PubChem CID 105307255) has the molecular formula C13H21F3N4 and a molecular weight of 290.33 g/mol. Its IUPAC name is [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
PubChem CID105307255
Molecular FormulaC13H21F3N4
Molecular Weight290.33 g/mol
Exact Mass290.17
IUPAC Name[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCCn1nccc1C(NN)C1CCCC(C(F)(F)F)C1
InChIInChI=1S/C13H21F3N4/c1-2-20-11(6-7-18-20)12(19-17)9-4-3-5-10(8-9)13(14,15)16/h6-7,9-10,12,19H,2-5,8,17H2,1H3
InChIKeyWTKOZCMTECMPPL-UHFFFAOYSA-N
XLogP2.78
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(2-propylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105307031
N-[(3-ethylcyclohexyl)-(2-ethylpyrazol-3-yl)methyl]ethanamine
CID 65415353
[7-bicyclo[4.1.0]heptanyl-(2-ethylpyrazol-3-yl)methyl]hydrazine
CID 105307270
1-cyclopentyl-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 63976376
N-[(2-ethylpyrazol-3-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 115761677
N-methyl-1-(2-propylpyrazol-3-yl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105148223
[(3-ethylcyclopentyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105233440
[(4-methoxyphenyl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105286260
N-[(1-ethylpyrazol-4-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 105109287
cyclooctyl-(2-ethylpyrazol-3-yl)methanamine
CID 80604016
[(2-methylcyclopropyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105234801
[2-cyclohexylsulfanyl-1-(2-ethylpyrazol-3-yl)ethyl]hydrazine
CID 105227851

Frequently Asked Questions

What is the IUPAC name of [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The IUPAC name of [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine (CID 105307255) is [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine.
What is the SMILES notation for [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The canonical SMILES for [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine is CCn1nccc1C(NN)C1CCCC(C(F)(F)F)C1.
What is the InChIKey of [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The InChIKey is WTKOZCMTECMPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21F3N4/c1-2-20-11(6-7-18-20)12(19-17)9-4-3-5-10(8-9)13(14,15)16/h6-7,9-10,12,19H,2-5,8,17H2,1H3.
What are the key properties of [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
[(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine has a molecular weight of 290.33 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-ethylpyrazol-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine is sourced from PubChem (CID 105307255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).