[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine

C14H19FN4O — CID 105252504

IUPAC[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(F)c1C(Cc1cc(C)nn1C)NN
InChIInChI=1S/C14H19FN4O/c1-9-7-10(19(2)18-9)8-12(17-16)14-11(15)5-4-6-13(14)20-3/h4-7,12,17H,8,16H2,1-3H3
InChIKeyODSXKFRBKFBIHT-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.62
Rot. Bonds5

About [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine

[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine (PubChem CID 105252504) has the molecular formula C14H19FN4O and a molecular weight of 278.33 g/mol. Its IUPAC name is [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
PubChem CID105252504
Molecular FormulaC14H19FN4O
Molecular Weight278.33 g/mol
Exact Mass278.15
IUPAC Name[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(F)c1C(Cc1cc(C)nn1C)NN
InChIInChI=1S/C14H19FN4O/c1-9-7-10(19(2)18-9)8-12(17-16)14-11(15)5-4-6-13(14)20-3/h4-7,12,17H,8,16H2,1-3H3
InChIKeyODSXKFRBKFBIHT-UHFFFAOYSA-N
XLogP1.62
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine (CID 105252504) is [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine is COc1cccc(F)c1C(Cc1cc(C)nn1C)NN.
What is the InChIKey of [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine?
The InChIKey is ODSXKFRBKFBIHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN4O/c1-9-7-10(19(2)18-9)8-12(17-16)14-11(15)5-4-6-13(14)20-3/h4-7,12,17H,8,16H2,1-3H3.
What are the key properties of [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine?
[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine has a molecular weight of 278.33 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105252504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).