[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine

C15H17F3N2O — CID 102759916

IUPAC[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cc(C(NN)c2ccc(C(F)(F)F)cc2C)c(C)o1
InChIInChI=1S/C15H17F3N2O/c1-8-6-11(15(16,17)18)4-5-12(8)14(20-19)13-7-9(2)21-10(13)3/h4-7,14,20H,19H2,1-3H3
InChIKeyJFZSJYLBPBMMJF-UHFFFAOYSA-N
MW298.31 g/mol
LogP3.78
Rot. Bonds3

About [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine

[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 102759916) has the molecular formula C15H17F3N2O and a molecular weight of 298.31 g/mol. Its IUPAC name is [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID102759916
Molecular FormulaC15H17F3N2O
Molecular Weight298.31 g/mol
Exact Mass298.13
IUPAC Name[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cc(C(NN)c2ccc(C(F)(F)F)cc2C)c(C)o1
InChIInChI=1S/C15H17F3N2O/c1-8-6-11(15(16,17)18)4-5-12(8)14(20-19)13-7-9(2)21-10(13)3/h4-7,14,20H,19H2,1-3H3
InChIKeyJFZSJYLBPBMMJF-UHFFFAOYSA-N
XLogP3.78
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.31
LogP ≤ 53.78
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

[(2-bromophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759477
[1-(2,5-dimethylfuran-3-yl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105299682
[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
CID 102759413
[(2,5-dimethylfuran-3-yl)-[2-(trifluoromethoxy)phenyl]methyl]hydrazine
CID 105301429
[(2,5-dimethylfuran-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 105300529
[[2-methyl-4-(trifluoromethyl)phenyl]-thiophen-3-ylmethyl]hydrazine
CID 102759414
[(5-bromothiophen-2-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759536
[(2,6-difluorophenyl)-(2,5-dimethylfuran-3-yl)methyl]hydrazine
CID 105308068
[[2-methyl-4-(trifluoromethyl)phenyl]-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 102760069
[(5-fluoro-3-pyridinyl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759931
2-bromo-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-(trifluoromethyl)aniline
CID 115511628
(1R)-1-[2-methyl-4-(trifluoromethyl)phenyl]ethanamine
CID 129373327

Frequently Asked Questions

What is the IUPAC name of [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine (CID 102759916) is [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1cc(C(NN)c2ccc(C(F)(F)F)cc2C)c(C)o1.
What is the InChIKey of [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is JFZSJYLBPBMMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F3N2O/c1-8-6-11(15(16,17)18)4-5-12(8)14(20-19)13-7-9(2)21-10(13)3/h4-7,14,20H,19H2,1-3H3.
What are the key properties of [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine?
[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 298.31 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 102759916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).