N-(2,6-difluorophenyl)acetohydrazide

C8H8F2N2O — CID 54144857

IUPACN-(2,6-difluorophenyl)acetohydrazide
SMILESCC(=O)N(N)c1c(F)cccc1F
InChIInChI=1S/C8H8F2N2O/c1-5(13)12(11)8-6(9)3-2-4-7(8)10/h2-4H,11H2,1H3
InChIKeyODQIHBVVNGFWOF-UHFFFAOYSA-N
MW186.16 g/mol
LogP1.19
Rot. Bonds1

About N-(2,6-difluorophenyl)acetohydrazide

N-(2,6-difluorophenyl)acetohydrazide (PubChem CID 54144857) has the molecular formula C8H8F2N2O and a molecular weight of 186.16 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)acetohydrazide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)acetohydrazide
PubChem CID54144857
Molecular FormulaC8H8F2N2O
Molecular Weight186.16 g/mol
Exact Mass186.06
IUPAC NameN-(2,6-difluorophenyl)acetohydrazide
SMILESCC(=O)N(N)c1c(F)cccc1F
InChIInChI=1S/C8H8F2N2O/c1-5(13)12(11)8-6(9)3-2-4-7(8)10/h2-4H,11H2,1H3
InChIKeyODQIHBVVNGFWOF-UHFFFAOYSA-N
XLogP1.19
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.16
LogP ≤ 51.19
H-Bond Donors ≤ 51
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 N-(2,6-difluorophenyl)acetohydrazide?
The IUPAC name of N-(2,6-difluorophenyl)acetohydrazide (CID 54144857) is N-(2,6-difluorophenyl)acetohydrazide.
What is the SMILES notation for N-(2,6-difluorophenyl)acetohydrazide?
The canonical SMILES for N-(2,6-difluorophenyl)acetohydrazide is CC(=O)N(N)c1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)acetohydrazide?
The InChIKey is ODQIHBVVNGFWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O/c1-5(13)12(11)8-6(9)3-2-4-7(8)10/h2-4H,11H2,1H3.
What are the key properties of N-(2,6-difluorophenyl)acetohydrazide?
N-(2,6-difluorophenyl)acetohydrazide has a molecular weight of 186.16 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)acetohydrazide is sourced from PubChem (CID 54144857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).