[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine

C8H11F3N4 — CID 62252952

IUPAC[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(CC(F)(F)F)nc(NN)c1C
InChIInChI=1S/C8H11F3N4/c1-4-5(2)13-6(3-8(9,10)11)14-7(4)15-12/h3,12H2,1-2H3,(H,13,14,15)
InChIKeyIFEHWLLXVKZSCK-UHFFFAOYSA-N
MW220.20 g/mol
LogP1.48
Rot. Bonds2

About [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine

[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine (PubChem CID 62252952) has the molecular formula C8H11F3N4 and a molecular weight of 220.20 g/mol. Its IUPAC name is [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine
PubChem CID62252952
Molecular FormulaC8H11F3N4
Molecular Weight220.20 g/mol
Exact Mass220.09
IUPAC Name[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(CC(F)(F)F)nc(NN)c1C
InChIInChI=1S/C8H11F3N4/c1-4-5(2)13-6(3-8(9,10)11)14-7(4)15-12/h3,12H2,1-2H3,(H,13,14,15)
InChIKeyIFEHWLLXVKZSCK-UHFFFAOYSA-N
XLogP1.48
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.48
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

N,5,6-trimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 62192540
[5,6-dimethyl-2-(3,3,3-trifluoropropyl)pyrimidin-4-yl]hydrazine
CID 79964597
[5,6-dimethyl-2-(3-methylbutyl)pyrimidin-4-yl]hydrazine
CID 62250159
N,5-diethyl-6-methyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 62191430
[2-[2-(2,2-difluoroethoxy)ethyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
CID 103150529
2-[4,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-5-yl]ethanamine
CID 62745948
[2-(2,2-dimethylpropyl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 63890900
[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
CID 64559876
[5,6-dimethyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
CID 62250532
5-iodo-6-methyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 66307691
[2-[(3,4-dimethylphenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
CID 55131052
[6-ethyl-2-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 63614031

Frequently Asked Questions

What is the IUPAC name of [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine (CID 62252952) is [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine is Cc1nc(CC(F)(F)F)nc(NN)c1C.
What is the InChIKey of [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine?
The InChIKey is IFEHWLLXVKZSCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4/c1-4-5(2)13-6(3-8(9,10)11)14-7(4)15-12/h3,12H2,1-2H3,(H,13,14,15).
What are the key properties of [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine?
[5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine has a molecular weight of 220.20 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-dimethyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62252952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).