2-(4-fluorophenyl)acetohydrazide

C8H9FN2O — CID 3771612

IUPAC2-(4-fluorophenyl)acetohydrazide
SMILESNNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-8(12)11-10/h1-4H,5,10H2,(H,11,12)
InChIKeyPFBNINAURUGQRR-UHFFFAOYSA-N
MW168.17 g/mol
LogP0.36
Rot. Bonds2

About 2-(4-fluorophenyl)acetohydrazide

2-(4-fluorophenyl)acetohydrazide (PubChem CID 3771612) has the molecular formula C8H9FN2O and a molecular weight of 168.17 g/mol. Its IUPAC name is 2-(4-fluorophenyl)acetohydrazide.

Molecular Properties

Compound Name2-(4-fluorophenyl)acetohydrazide
PubChem CID3771612
Molecular FormulaC8H9FN2O
Molecular Weight168.17 g/mol
Exact Mass168.07
IUPAC Name2-(4-fluorophenyl)acetohydrazide
SMILESNNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-8(12)11-10/h1-4H,5,10H2,(H,11,12)
InChIKeyPFBNINAURUGQRR-UHFFFAOYSA-N
XLogP0.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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-(4-fluorophenyl)acetohydrazide?
The IUPAC name of 2-(4-fluorophenyl)acetohydrazide (CID 3771612) is 2-(4-fluorophenyl)acetohydrazide.
What is the SMILES notation for 2-(4-fluorophenyl)acetohydrazide?
The canonical SMILES for 2-(4-fluorophenyl)acetohydrazide is NNC(=O)Cc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)acetohydrazide?
The InChIKey is PFBNINAURUGQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-8(12)11-10/h1-4H,5,10H2,(H,11,12).
What are the key properties of 2-(4-fluorophenyl)acetohydrazide?
2-(4-fluorophenyl)acetohydrazide has a molecular weight of 168.17 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)acetohydrazide is sourced from PubChem (CID 3771612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).