2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide

C11H14F2N2O — CID 116847169

IUPAC2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide
SMILESCNNC(=O)C(C)(C)c1cc(F)ccc1F
InChIInChI=1S/C11H14F2N2O/c1-11(2,10(16)15-14-3)8-6-7(12)4-5-9(8)13/h4-6,14H,1-3H3,(H,15,16)
InChIKeyYTOFTKZCLDAKME-UHFFFAOYSA-N
MW228.24 g/mol
LogP1.49
Rot. Bonds3

About 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide

2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide (PubChem CID 116847169) has the molecular formula C11H14F2N2O and a molecular weight of 228.24 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide
PubChem CID116847169
Molecular FormulaC11H14F2N2O
Molecular Weight228.24 g/mol
Exact Mass228.11
IUPAC Name2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide
SMILESCNNC(=O)C(C)(C)c1cc(F)ccc1F
InChIInChI=1S/C11H14F2N2O/c1-11(2,10(16)15-14-3)8-6-7(12)4-5-9(8)13/h4-6,14H,1-3H3,(H,15,16)
InChIKeyYTOFTKZCLDAKME-UHFFFAOYSA-N
XLogP1.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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N''-butyl-3-phenylpropanehydrazide
CID 139575788
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CID 2736674
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CID 43244770
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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide?
The IUPAC name of 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide (CID 116847169) is 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide.
What is the SMILES notation for 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide?
The canonical SMILES for 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide is CNNC(=O)C(C)(C)c1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide?
The InChIKey is YTOFTKZCLDAKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O/c1-11(2,10(16)15-14-3)8-6-7(12)4-5-9(8)13/h4-6,14H,1-3H3,(H,15,16).
What are the key properties of 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide?
2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide has a molecular weight of 228.24 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-N',2-dimethylpropanehydrazide is sourced from PubChem (CID 116847169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).