[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

C13H13F3N4 — CID 105301358

IUPAC[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cnc(C(NN)c2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C13H13F3N4/c1-8-6-19-11(7-18-8)12(20-17)9-3-2-4-10(5-9)13(14,15)16/h2-7,12,20H,17H2,1H3
InChIKeySEAUBBJAJOENJC-UHFFFAOYSA-N
MW282.27 g/mol
LogP2.36
Rot. Bonds3

About [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105301358) has the molecular formula C13H13F3N4 and a molecular weight of 282.27 g/mol. Its IUPAC name is [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105301358
Molecular FormulaC13H13F3N4
Molecular Weight282.27 g/mol
Exact Mass282.11
IUPAC Name[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cnc(C(NN)c2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C13H13F3N4/c1-8-6-19-11(7-18-8)12(20-17)9-3-2-4-10(5-9)13(14,15)16/h2-7,12,20H,17H2,1H3
InChIKeySEAUBBJAJOENJC-UHFFFAOYSA-N
XLogP2.36
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 52.36
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

[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[1,2,5-thiadiazol-3-yl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301323
[(4-fluoro-3-methylphenyl)-(5-methylpyrazin-2-yl)methyl]hydrazine
CID 105302633
[(1,5-dimethylpyrazol-4-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301348
[(2,6-difluorophenyl)-(5-methylpyrazin-2-yl)methyl]hydrazine
CID 105308106
[(3-chloro-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301346
[(2,5-dimethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193884
[(4-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105192836
[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193954
[furan-2-yl-(5-methylpyrazin-2-yl)methyl]hydrazine
CID 105306068
[2,2,2-trifluoro-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 53402398
(2,6-dimethyl-4-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 107503114

Frequently Asked Questions

What is the IUPAC name of [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105301358) is [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1cnc(C(NN)c2cccc(C(F)(F)F)c2)cn1.
What is the InChIKey of [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is SEAUBBJAJOENJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N4/c1-8-6-19-11(7-18-8)12(20-17)9-3-2-4-10(5-9)13(14,15)16/h2-7,12,20H,17H2,1H3.
What are the key properties of [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 282.27 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-methylpyrazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105301358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).