3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide

C11H8ClFN2OS — CID 2812141

IUPAC3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide
SMILESO=C(NNc1ccccc1F)c1sccc1Cl
InChIInChI=1S/C11H8ClFN2OS/c12-7-5-6-17-10(7)11(16)15-14-9-4-2-1-3-8(9)13/h1-6,14H,(H,15,16)
InChIKeyAOKVXDZODHECSC-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.30
Rot. Bonds3

About 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide

3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide (PubChem CID 2812141) has the molecular formula C11H8ClFN2OS and a molecular weight of 270.72 g/mol. Its IUPAC name is 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound Name3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide
PubChem CID2812141
Molecular FormulaC11H8ClFN2OS
Molecular Weight270.72 g/mol
Exact Mass270.00
IUPAC Name3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide
SMILESO=C(NNc1ccccc1F)c1sccc1Cl
InChIInChI=1S/C11H8ClFN2OS/c12-7-5-6-17-10(7)11(16)15-14-9-4-2-1-3-8(9)13/h1-6,14H,(H,15,16)
InChIKeyAOKVXDZODHECSC-UHFFFAOYSA-N
XLogP3.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide?
The IUPAC name of 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide (CID 2812141) is 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide.
What is the SMILES notation for 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide?
The canonical SMILES for 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide is O=C(NNc1ccccc1F)c1sccc1Cl.
What is the InChIKey of 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide?
The InChIKey is AOKVXDZODHECSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2OS/c12-7-5-6-17-10(7)11(16)15-14-9-4-2-1-3-8(9)13/h1-6,14H,(H,15,16).
What are the key properties of 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide?
3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide has a molecular weight of 270.72 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 2812141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).