[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine

C14H17F3N4 — CID 105307552

IUPAC[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCCCn1ccnc1C(NN)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H17F3N4/c1-2-8-21-9-7-19-13(21)12(20-18)10-3-5-11(6-4-10)14(15,16)17/h3-7,9,12,20H,2,8,18H2,1H3
InChIKeyXYQPJGIIZXGCHL-UHFFFAOYSA-N
MW298.31 g/mol
LogP2.86
Rot. Bonds5

About [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine

[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105307552) has the molecular formula C14H17F3N4 and a molecular weight of 298.31 g/mol. Its IUPAC name is [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105307552
Molecular FormulaC14H17F3N4
Molecular Weight298.31 g/mol
Exact Mass298.14
IUPAC Name[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCCCn1ccnc1C(NN)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H17F3N4/c1-2-8-21-9-7-19-13(21)12(20-18)10-3-5-11(6-4-10)14(15,16)17/h3-7,9,12,20H,2,8,18H2,1H3
InChIKeyXYQPJGIIZXGCHL-UHFFFAOYSA-N
XLogP2.86
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.31
LogP ≤ 52.86
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

[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105193319
[(3-bromophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105197993
[(2-methylpyrazol-3-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307580
[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine
CID 105308467
[(3-fluoro-2-pyridinyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105257823
[(1-propylpyrazol-4-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105288436
[(3-bromo-4-methylphenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308418
(1-propylimidazol-2-yl)-[3-(trifluoromethyl)phenyl]methanamine
CID 61316673
[(2,5-difluorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105219387
[(1-ethylimidazol-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105196054
[(2-chloro-3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307653
[2,2-difluoro-1-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105265098

Frequently Asked Questions

What is the IUPAC name of [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105307552) is [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine is CCCn1ccnc1C(NN)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is XYQPJGIIZXGCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N4/c1-2-8-21-9-7-19-13(21)12(20-18)10-3-5-11(6-4-10)14(15,16)17/h3-7,9,12,20H,2,8,18H2,1H3.
What are the key properties of [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 298.31 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105307552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).