[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine

C14H15F3N4 — CID 63559694

IUPAC[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccccc2C(F)(F)F)nc(NN)c1C
InChIInChI=1S/C14H15F3N4/c1-3-11-8(2)12(21-18)20-13(19-11)9-6-4-5-7-10(9)14(15,16)17/h4-7H,3,18H2,1-2H3,(H,19,20,21)
InChIKeyORZWITVFJJXEFX-UHFFFAOYSA-N
MW296.30 g/mol
LogP3.32
Rot. Bonds3

About [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine

[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine (PubChem CID 63559694) has the molecular formula C14H15F3N4 and a molecular weight of 296.30 g/mol. Its IUPAC name is [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine
PubChem CID63559694
Molecular FormulaC14H15F3N4
Molecular Weight296.30 g/mol
Exact Mass296.12
IUPAC Name[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccccc2C(F)(F)F)nc(NN)c1C
InChIInChI=1S/C14H15F3N4/c1-3-11-8(2)12(21-18)20-13(19-11)9-6-4-5-7-10(9)14(15,16)17/h4-7H,3,18H2,1-2H3,(H,19,20,21)
InChIKeyORZWITVFJJXEFX-UHFFFAOYSA-N
XLogP3.32
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.30
LogP ≤ 53.32
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

[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine
CID 79718877
[2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 63560270
5,6-dimethyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 62202485
2-(2-chlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63560185
[6-ethyl-2-(3-ethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine
CID 82741821
[6-ethyl-2-(3-fluoro-4-methylphenyl)-5-methylpyrimidin-4-yl]hydrazine
CID 63562540
5,6-dimethyl-N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine;iodomethane
CID 159993039
5-iodo-N,6-dimethyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 66295542
[5,6-dimethyl-2-[2-(trifluoromethoxy)phenyl]pyrimidin-4-yl]hydrazine
CID 62251303
[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 79980375
[5,6-dimethyl-2-(2-methylphenyl)pyrimidin-4-yl]hydrazine
CID 62252584
(6-ethyl-5-methyl-2-pyrazin-2-ylpyrimidin-4-yl)hydrazine
CID 63560830

Frequently Asked Questions

What is the IUPAC name of [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine (CID 63559694) is [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine is CCc1nc(-c2ccccc2C(F)(F)F)nc(NN)c1C.
What is the InChIKey of [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine?
The InChIKey is ORZWITVFJJXEFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N4/c1-3-11-8(2)12(21-18)20-13(19-11)9-6-4-5-7-10(9)14(15,16)17/h4-7H,3,18H2,1-2H3,(H,19,20,21).
What are the key properties of [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine?
[6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine has a molecular weight of 296.30 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-ethyl-5-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63559694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).