[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

C13H17FN4 — CID 103026016

IUPAC[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccccc1F
InChIInChI=1S/C13H17FN4/c1-18-10(8-9-16-18)6-7-13(17-15)11-4-2-3-5-12(11)14/h2-5,8-9,13,17H,6-7,15H2,1H3
InChIKeyAXOLFCUDZLWXII-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.70
Rot. Bonds5

About [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (PubChem CID 103026016) has the molecular formula C13H17FN4 and a molecular weight of 248.31 g/mol. Its IUPAC name is [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
PubChem CID103026016
Molecular FormulaC13H17FN4
Molecular Weight248.31 g/mol
Exact Mass248.14
IUPAC Name[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccccc1F
InChIInChI=1S/C13H17FN4/c1-18-10(8-9-16-18)6-7-13(17-15)11-4-2-3-5-12(11)14/h2-5,8-9,13,17H,6-7,15H2,1H3
InChIKeyAXOLFCUDZLWXII-UHFFFAOYSA-N
XLogP1.70
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.70
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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Frequently Asked Questions

What is the IUPAC name of [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The IUPAC name of [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (CID 103026016) is [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.
What is the SMILES notation for [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The canonical SMILES for [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is Cn1nccc1CCC(NN)c1ccccc1F.
What is the InChIKey of [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The InChIKey is AXOLFCUDZLWXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN4/c1-18-10(8-9-16-18)6-7-13(17-15)11-4-2-3-5-12(11)14/h2-5,8-9,13,17H,6-7,15H2,1H3.
What are the key properties of [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
[1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine has a molecular weight of 248.31 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluorophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is sourced from PubChem (CID 103026016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).