[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine

C14H14F3N3O — CID 105286222

IUPAC[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(C(F)(F)F)cn2)cc1
InChIInChI=1S/C14H14F3N3O/c1-21-11-5-2-9(3-6-11)13(20-18)12-7-4-10(8-19-12)14(15,16)17/h2-8,13,20H,18H2,1H3
InChIKeyWBIIQPKMGXCWHZ-UHFFFAOYSA-N
MW297.28 g/mol
LogP2.66
Rot. Bonds4

About [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine

[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine (PubChem CID 105286222) has the molecular formula C14H14F3N3O and a molecular weight of 297.28 g/mol. Its IUPAC name is [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine.

Molecular Properties

Compound Name[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
PubChem CID105286222
Molecular FormulaC14H14F3N3O
Molecular Weight297.28 g/mol
Exact Mass297.11
IUPAC Name[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(C(F)(F)F)cn2)cc1
InChIInChI=1S/C14H14F3N3O/c1-21-11-5-2-9(3-6-11)13(20-18)12-7-4-10(8-19-12)14(15,16)17/h2-8,13,20H,18H2,1H3
InChIKeyWBIIQPKMGXCWHZ-UHFFFAOYSA-N
XLogP2.66
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.28
LogP ≤ 52.66
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

[(5-methoxy-3-pyridinyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105329743
[(2-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105285707
[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190992
[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105287046
1-(4-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105087924
[(4-methoxyphenyl)-pyrazin-2-ylmethyl]hydrazine
CID 105190970
[(4-methoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105190882
[(5-fluoro-2-methylphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105302169
[(3-ethyltriazol-4-yl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 114213659
1-(3-methoxypyrazin-2-yl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105178613
[(4-methoxyphenyl)-(4-methyl-2-pyridinyl)methyl]hydrazine
CID 105219978
[(4-methoxyphenyl)-quinolin-2-ylmethyl]hydrazine
CID 105218693

Frequently Asked Questions

What is the IUPAC name of [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The IUPAC name of [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine (CID 105286222) is [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine.
What is the SMILES notation for [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The canonical SMILES for [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine is COc1ccc(C(NN)c2ccc(C(F)(F)F)cn2)cc1.
What is the InChIKey of [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
The InChIKey is WBIIQPKMGXCWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3O/c1-21-11-5-2-9(3-6-11)13(20-18)12-7-4-10(8-19-12)14(15,16)17/h2-8,13,20H,18H2,1H3.
What are the key properties of [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine?
[(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine has a molecular weight of 297.28 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methoxyphenyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine is sourced from PubChem (CID 105286222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).