[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine

C14H13BrF3N3 — CID 105193872

IUPAC[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cn1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H13BrF3N3/c15-11-4-5-12(20-8-11)7-13(21-19)9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2
InChIKeyNPEPGJCOUIFFSP-UHFFFAOYSA-N
MW360.18 g/mol
LogP3.61
Rot. Bonds4

About [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine

[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine (PubChem CID 105193872) has the molecular formula C14H13BrF3N3 and a molecular weight of 360.18 g/mol. Its IUPAC name is [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
PubChem CID105193872
Molecular FormulaC14H13BrF3N3
Molecular Weight360.18 g/mol
Exact Mass359.02
IUPAC Name[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cn1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H13BrF3N3/c15-11-4-5-12(20-8-11)7-13(21-19)9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2
InChIKeyNPEPGJCOUIFFSP-UHFFFAOYSA-N
XLogP3.61
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.18
LogP ≤ 53.61
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

[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[2-(4-iodophenyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105193885
[2-(5-bromo-2-pyridinyl)-1-(2,4-difluoro-5-methylphenyl)ethyl]hydrazine
CID 105334604
[2-(5-bromo-2-pyridinyl)-1-quinolin-5-ylethyl]hydrazine
CID 105334462
[2-(5-bromo-2-pyridinyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105334474
[2-(4-methyl-1,3-thiazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105193895
[2-(5-bromo-2-pyridinyl)-1-(1H-1,2,4-triazol-5-yl)ethyl]hydrazine
CID 105230433
[3-methoxy-3-methyl-1-[3-(trifluoromethyl)phenyl]butyl]hydrazine
CID 103025278
[5-methyl-1-[3-(trifluoromethyl)phenyl]hexyl]hydrazine
CID 105193980
[3-methylsulfanyl-1-[3-(trifluoromethyl)phenyl]propyl]hydrazine
CID 105301345
1-[3-(trifluoromethyl)phenyl]nonylhydrazine
CID 105193857
[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301356

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine (CID 105193872) is [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine is NNC(Cc1ccc(Br)cn1)c1cccc(C(F)(F)F)c1.
What is the InChIKey of [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The InChIKey is NPEPGJCOUIFFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrF3N3/c15-11-4-5-12(20-8-11)7-13(21-19)9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2.
What are the key properties of [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
[2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine has a molecular weight of 360.18 g/mol, XLogP of 3.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105193872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).