[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine

C11H9F3N4 — CID 112559499

IUPAC[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine
SMILESNNc1nccnc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C11H9F3N4/c12-11(13,14)8-4-2-1-3-7(8)9-10(18-15)17-6-5-16-9/h1-6H,15H2,(H,17,18)
InChIKeyIRHXLAXJNXWHHG-UHFFFAOYSA-N
MW254.22 g/mol
LogP2.45
Rot. Bonds2

About [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine

[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine (PubChem CID 112559499) has the molecular formula C11H9F3N4 and a molecular weight of 254.22 g/mol. Its IUPAC name is [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine
PubChem CID112559499
Molecular FormulaC11H9F3N4
Molecular Weight254.22 g/mol
Exact Mass254.08
IUPAC Name[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine
SMILESNNc1nccnc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C11H9F3N4/c12-11(13,14)8-4-2-1-3-7(8)9-10(18-15)17-6-5-16-9/h1-6H,15H2,(H,17,18)
InChIKeyIRHXLAXJNXWHHG-UHFFFAOYSA-N
XLogP2.45
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.22
LogP ≤ 52.45
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

3-[2-(trifluoromethyl)phenyl]-2-[2-[2-[3-[2-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]phenyl]pyridine
CID 58947587
4-fluoro-3-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridine
CID 118850193
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
[5-[2-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 14091197
[3-[2-(trifluoromethyl)phenyl]phenyl]hydrazine;hydrochloride
CID 171157644
[6-[2-(trifluoromethyl)phenyl]pyridazin-3-yl]hydrazine
CID 62041944
2,5-bis[2-(trifluoromethyl)phenyl]pyridin-3-amine
CID 134624057
6-[2-(trifluoromethyl)phenyl]-1,2,4-triazine-3,5-diamine
CID 23311136
[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine
CID 63559694
6-(trifluoromethyl)-2,4-bis[2-(trifluoromethyl)phenyl]pyridin-3-amine
CID 134624265
3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine
CID 134623597
2,4-bis[2-(trifluoromethyl)phenyl]pyrimidine
CID 174722117

Frequently Asked Questions

What is the IUPAC name of [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine?
The IUPAC name of [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine (CID 112559499) is [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine.
What is the SMILES notation for [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine?
The canonical SMILES for [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine is NNc1nccnc1-c1ccccc1C(F)(F)F.
What is the InChIKey of [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine?
The InChIKey is IRHXLAXJNXWHHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N4/c12-11(13,14)8-4-2-1-3-7(8)9-10(18-15)17-6-5-16-9/h1-6H,15H2,(H,17,18).
What are the key properties of [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine?
[3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine has a molecular weight of 254.22 g/mol, XLogP of 2.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(trifluoromethyl)phenyl]pyrazin-2-yl]hydrazine is sourced from PubChem (CID 112559499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).