[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine

C12H14F4N2 — CID 107292329

IUPAC[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine
SMILESCC1CC1C(NN)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C12H14F4N2/c1-6-4-8(6)11(18-17)7-2-3-10(13)9(5-7)12(14,15)16/h2-3,5-6,8,11,18H,4,17H2,1H3
InChIKeyAPPDDDLEHNRUAV-UHFFFAOYSA-N
MW262.25 g/mol
LogP3.00
Rot. Bonds3

About [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine

[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine (PubChem CID 107292329) has the molecular formula C12H14F4N2 and a molecular weight of 262.25 g/mol. Its IUPAC name is [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine.

Molecular Properties

Compound Name[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine
PubChem CID107292329
Molecular FormulaC12H14F4N2
Molecular Weight262.25 g/mol
Exact Mass262.11
IUPAC Name[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine
SMILESCC1CC1C(NN)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C12H14F4N2/c1-6-4-8(6)11(18-17)7-2-3-10(13)9(5-7)12(14,15)16/h2-3,5-6,8,11,18H,4,17H2,1H3
InChIKeyAPPDDDLEHNRUAV-UHFFFAOYSA-N
XLogP3.00
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.25
LogP ≤ 53.00
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

N-[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]propan-1-amine
CID 107289047
[cyclohexyl-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105282065
[[4-fluoro-3-(trifluoromethyl)phenyl]-(thiolan-2-yl)methyl]hydrazine
CID 107292378
[[4-fluoro-3-(trifluoromethyl)phenyl]-(oxan-3-yl)methyl]hydrazine
CID 107139797
[(2-fluoro-5-methylphenyl)-(2-methylcyclopropyl)methyl]hydrazine
CID 105234789
[(4-fluoro-3-methylphenyl)-(2-methylcyclopentyl)methyl]hydrazine
CID 107193800
[(2,2-dimethylcyclopropyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292542
[(2,6-difluorophenyl)-(2-methylcyclopropyl)methyl]hydrazine
CID 105234813
[1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methylbutyl]hydrazine
CID 105325763
2-cyclopentyl-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanamine
CID 115847288
1-[4-fluoro-3-(trifluoromethyl)phenyl]-N-methyl-1-(oxan-4-yl)methanamine
CID 115855875
[4-fluoro-3-(trifluoromethyl)phenyl]-(5-methyloxolan-3-yl)methanamine
CID 107291977

Frequently Asked Questions

What is the IUPAC name of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine?
The IUPAC name of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine (CID 107292329) is [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine.
What is the SMILES notation for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine?
The canonical SMILES for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine is CC1CC1C(NN)c1ccc(F)c(C(F)(F)F)c1.
What is the InChIKey of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine?
The InChIKey is APPDDDLEHNRUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F4N2/c1-6-4-8(6)11(18-17)7-2-3-10(13)9(5-7)12(14,15)16/h2-3,5-6,8,11,18H,4,17H2,1H3.
What are the key properties of [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine?
[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine has a molecular weight of 262.25 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylcyclopropyl)methyl]hydrazine is sourced from PubChem (CID 107292329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).