2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide

C8H11FN2OS — CID 119094952

IUPAC2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide
SMILESCC(C)(C(=O)NN)c1ccc(F)s1
InChIInChI=1S/C8H11FN2OS/c1-8(2,7(12)11-10)5-3-4-6(9)13-5/h3-4H,10H2,1-2H3,(H,11,12)
InChIKeyMJPHYHLFLOCACE-UHFFFAOYSA-N
MW202.25 g/mol
LogP1.15
Rot. Bonds2

About 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide

2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide (PubChem CID 119094952) has the molecular formula C8H11FN2OS and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide.

Molecular Properties

Compound Name2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide
PubChem CID119094952
Molecular FormulaC8H11FN2OS
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC Name2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide
SMILESCC(C)(C(=O)NN)c1ccc(F)s1
InChIInChI=1S/C8H11FN2OS/c1-8(2,7(12)11-10)5-3-4-6(9)13-5/h3-4H,10H2,1-2H3,(H,11,12)
InChIKeyMJPHYHLFLOCACE-UHFFFAOYSA-N
XLogP1.15
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide?
The IUPAC name of 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide (CID 119094952) is 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide.
What is the SMILES notation for 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide?
The canonical SMILES for 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide is CC(C)(C(=O)NN)c1ccc(F)s1.
What is the InChIKey of 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide?
The InChIKey is MJPHYHLFLOCACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2OS/c1-8(2,7(12)11-10)5-3-4-6(9)13-5/h3-4H,10H2,1-2H3,(H,11,12).
What are the key properties of 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide?
2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide has a molecular weight of 202.25 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluorothiophen-2-yl)-2-methylpropanehydrazide is sourced from PubChem (CID 119094952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).