[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine

C5H6F3N5 — CID 71399542

IUPAC[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine
SMILESCc1nc(NN)nc(C(F)(F)F)n1
InChIInChI=1S/C5H6F3N5/c1-2-10-3(5(6,7)8)12-4(11-2)13-9/h9H2,1H3,(H,10,11,12,13)
InChIKeyWDEHPLAACLPGOZ-UHFFFAOYSA-N
MW193.13 g/mol
LogP0.48
Rot. Bonds1

About [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine

[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine (PubChem CID 71399542) has the molecular formula C5H6F3N5 and a molecular weight of 193.13 g/mol. Its IUPAC name is [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine
PubChem CID71399542
Molecular FormulaC5H6F3N5
Molecular Weight193.13 g/mol
Exact Mass193.06
IUPAC Name[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine
SMILESCc1nc(NN)nc(C(F)(F)F)n1
InChIInChI=1S/C5H6F3N5/c1-2-10-3(5(6,7)8)12-4(11-2)13-9/h9H2,1H3,(H,10,11,12,13)
InChIKeyWDEHPLAACLPGOZ-UHFFFAOYSA-N
XLogP0.48
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.13
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine (CID 71399542) is [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine is Cc1nc(NN)nc(C(F)(F)F)n1.
What is the InChIKey of [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is WDEHPLAACLPGOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F3N5/c1-2-10-3(5(6,7)8)12-4(11-2)13-9/h9H2,1H3,(H,10,11,12,13).
What are the key properties of [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine?
[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 193.13 g/mol, XLogP of 0.48, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 71399542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).