[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine

C13H19F3N2S — CID 105313336

IUPAC[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCc1cc(C(NN)C2CCC(C(F)(F)F)CC2)cs1
InChIInChI=1S/C13H19F3N2S/c1-8-6-10(7-19-8)12(18-17)9-2-4-11(5-3-9)13(14,15)16/h6-7,9,11-12,18H,2-5,17H2,1H3
InChIKeyLGDLMBNFKDJQIS-UHFFFAOYSA-N
MW292.37 g/mol
LogP3.93
Rot. Bonds3

About [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine

[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine (PubChem CID 105313336) has the molecular formula C13H19F3N2S and a molecular weight of 292.37 g/mol. Its IUPAC name is [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine.

Molecular Properties

Compound Name[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
PubChem CID105313336
Molecular FormulaC13H19F3N2S
Molecular Weight292.37 g/mol
Exact Mass292.12
IUPAC Name[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESCc1cc(C(NN)C2CCC(C(F)(F)F)CC2)cs1
InChIInChI=1S/C13H19F3N2S/c1-8-6-10(7-19-8)12(18-17)9-2-4-11(5-3-9)13(14,15)16/h6-7,9,11-12,18H,2-5,17H2,1H3
InChIKeyLGDLMBNFKDJQIS-UHFFFAOYSA-N
XLogP3.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[cyclopentyl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105204481
[(5-methylthiophen-3-yl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232352
[(3,5-difluorophenyl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105301886
[7-bicyclo[4.1.0]heptanyl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313323
N-[(5-methylthiophen-3-yl)-[3-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 105155633
[(5-methyloxolan-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313359
1-cycloheptyl-N-methyl-1-(5-methylthiophen-3-yl)methanamine
CID 65399489
tert-butyl 3-[hydrazinyl-(5-methylthiophen-3-yl)methyl]pyrrolidine-1-carboxylate
CID 107093189
[3,3,3-trifluoro-1-(5-methylthiophen-3-yl)-2-(trifluoromethyl)propyl]hydrazine
CID 103312828
[(5-bromothiophen-3-yl)-cycloheptylmethyl]hydrazine
CID 105330730
N-methyl-1-thiophen-3-yl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105154131
[cycloheptyl-(5-iodothiophen-3-yl)methyl]hydrazine
CID 105330732

Frequently Asked Questions

What is the IUPAC name of [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The IUPAC name of [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine (CID 105313336) is [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine.
What is the SMILES notation for [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The canonical SMILES for [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine is Cc1cc(C(NN)C2CCC(C(F)(F)F)CC2)cs1.
What is the InChIKey of [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The InChIKey is LGDLMBNFKDJQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19F3N2S/c1-8-6-10(7-19-8)12(18-17)9-2-4-11(5-3-9)13(14,15)16/h6-7,9,11-12,18H,2-5,17H2,1H3.
What are the key properties of [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
[(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine has a molecular weight of 292.37 g/mol, XLogP of 3.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-methylthiophen-3-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine is sourced from PubChem (CID 105313336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).