[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine

C14H14F3N3 — CID 102759413

IUPAC[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
SMILESCc1cc(C(F)(F)F)ccc1C(NN)c1ccncc1
InChIInChI=1S/C14H14F3N3/c1-9-8-11(14(15,16)17)2-3-12(9)13(20-18)10-4-6-19-7-5-10/h2-8,13,20H,18H2,1H3
InChIKeyFLMMXWIQHRTYMC-UHFFFAOYSA-N
MW281.28 g/mol
LogP2.96
Rot. Bonds3

About [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine

[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine (PubChem CID 102759413) has the molecular formula C14H14F3N3 and a molecular weight of 281.28 g/mol. Its IUPAC name is [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine.

Molecular Properties

Compound Name[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
PubChem CID102759413
Molecular FormulaC14H14F3N3
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC Name[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
SMILESCc1cc(C(F)(F)F)ccc1C(NN)c1ccncc1
InChIInChI=1S/C14H14F3N3/c1-9-8-11(14(15,16)17)2-3-12(9)13(20-18)10-4-6-19-7-5-10/h2-8,13,20H,18H2,1H3
InChIKeyFLMMXWIQHRTYMC-UHFFFAOYSA-N
XLogP2.96
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]ethanamine
CID 102753570
[(5-fluoro-3-pyridinyl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759931
[pyridin-4-yl-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105196567
[[2-methyl-4-(trifluoromethyl)phenyl]-thiophen-3-ylmethyl]hydrazine
CID 102759414
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
[(2,5-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105292454
[(2-methyl-4-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 106756526
[(2-bromophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759477
[(2,5-dimethylfuran-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759916
[[2-methyl-4-(trifluoromethyl)phenyl]-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 102760069
[(3,4-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105300140
[(5-bromothiophen-2-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 102759536

Frequently Asked Questions

What is the IUPAC name of [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine?
The IUPAC name of [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine (CID 102759413) is [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine.
What is the SMILES notation for [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine?
The canonical SMILES for [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine is Cc1cc(C(F)(F)F)ccc1C(NN)c1ccncc1.
What is the InChIKey of [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine?
The InChIKey is FLMMXWIQHRTYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3/c1-9-8-11(14(15,16)17)2-3-12(9)13(20-18)10-4-6-19-7-5-10/h2-8,13,20H,18H2,1H3.
What are the key properties of [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine?
[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine has a molecular weight of 281.28 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine is sourced from PubChem (CID 102759413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).