[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine

C12H11F3N4 — CID 105287046

IUPAC[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
SMILESNNC(c1cccnc1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C12H11F3N4/c13-12(14,15)9-3-4-10(18-7-9)11(19-16)8-2-1-5-17-6-8/h1-7,11,19H,16H2
InChIKeyKGVRZEGBYXUDJG-UHFFFAOYSA-N
MW268.24 g/mol
LogP2.05
Rot. Bonds3

About [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine

[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine (PubChem CID 105287046) has the molecular formula C12H11F3N4 and a molecular weight of 268.24 g/mol. Its IUPAC name is [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine.

Molecular Properties

Compound Name[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
PubChem CID105287046
Molecular FormulaC12H11F3N4
Molecular Weight268.24 g/mol
Exact Mass268.09
IUPAC Name[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
SMILESNNC(c1cccnc1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C12H11F3N4/c13-12(14,15)9-3-4-10(18-7-9)11(19-16)8-2-1-5-17-6-8/h1-7,11,19H,16H2
InChIKeyKGVRZEGBYXUDJG-UHFFFAOYSA-N
XLogP2.05
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.24
LogP ≤ 52.05
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-methoxy-3-pyridinyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105329743
[(2-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105285707
[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105286222
[pyridin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786696
[[3-fluoro-4-(trifluoromethyl)phenyl]-pyridin-3-ylmethyl]hydrazine
CID 107292241
[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[(5-fluoro-2-methylphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105302169
[cyclohepten-1-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 106650233
N-[pyrazin-2-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]ethanamine
CID 105150068
N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105173821
[(3-ethyltriazol-4-yl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 114213659
[(3,4-difluorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105196161

Frequently Asked Questions

What is the IUPAC name of [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The IUPAC name of [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine (CID 105287046) is [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine.
What is the SMILES notation for [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The canonical SMILES for [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine is NNC(c1cccnc1)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The InChIKey is KGVRZEGBYXUDJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N4/c13-12(14,15)9-3-4-10(18-7-9)11(19-16)8-2-1-5-17-6-8/h1-7,11,19H,16H2.
What are the key properties of [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine has a molecular weight of 268.24 g/mol, XLogP of 2.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine is sourced from PubChem (CID 105287046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).