2-(3,4-difluorophenoxy)pentanehydrazide

C11H14F2N2O2 — CID 83048019

IUPAC2-(3,4-difluorophenoxy)pentanehydrazide
SMILESCCCC(Oc1ccc(F)c(F)c1)C(=O)NN
InChIInChI=1S/C11H14F2N2O2/c1-2-3-10(11(16)15-14)17-7-4-5-8(12)9(13)6-7/h4-6,10H,2-3,14H2,1H3,(H,15,16)
InChIKeyBLISUJRFJPZXAI-UHFFFAOYSA-N
MW244.24 g/mol
LogP1.50
Rot. Bonds5

About 2-(3,4-difluorophenoxy)pentanehydrazide

2-(3,4-difluorophenoxy)pentanehydrazide (PubChem CID 83048019) has the molecular formula C11H14F2N2O2 and a molecular weight of 244.24 g/mol. Its IUPAC name is 2-(3,4-difluorophenoxy)pentanehydrazide.

Molecular Properties

Compound Name2-(3,4-difluorophenoxy)pentanehydrazide
PubChem CID83048019
Molecular FormulaC11H14F2N2O2
Molecular Weight244.24 g/mol
Exact Mass244.10
IUPAC Name2-(3,4-difluorophenoxy)pentanehydrazide
SMILESCCCC(Oc1ccc(F)c(F)c1)C(=O)NN
InChIInChI=1S/C11H14F2N2O2/c1-2-3-10(11(16)15-14)17-7-4-5-8(12)9(13)6-7/h4-6,10H,2-3,14H2,1H3,(H,15,16)
InChIKeyBLISUJRFJPZXAI-UHFFFAOYSA-N
XLogP1.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.24
LogP ≤ 51.50
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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Related Compounds

2-naphthalen-2-yloxypentanehydrazide
CID 54792972
2-[4-(trifluoromethyl)phenoxy]pentanehydrazide
CID 83047631
ethyl 2-(4-fluoro-3-methylphenoxy)pentanoate
CID 83037537
2-(3,4-difluorophenoxy)butanoic acid
CID 43808864
2-(3-fluoro-4-methylphenoxy)-3-methoxypropanehydrazide
CID 107171064
2-(3-methylsulfonylphenoxy)pentanehydrazide
CID 83048030
2-(5-bromo-2,3-difluorophenoxy)pentanehydrazide
CID 107101957
2-(3-fluoro-4-methylphenoxy)pentanoic acid
CID 107168408
2-fluoro-6-(1-hydrazinyl-1-oxopentan-2-yl)oxybenzamide
CID 83047514
2-(4-acetyl-3-fluorophenoxy)-3-methoxypropanehydrazide
CID 107718981
methyl 2-(4-chlorophenoxy)pentanoate
CID 15744144
2-(2,6-dimethylphenoxy)pentanehydrazide
CID 54792907

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenoxy)pentanehydrazide?
The IUPAC name of 2-(3,4-difluorophenoxy)pentanehydrazide (CID 83048019) is 2-(3,4-difluorophenoxy)pentanehydrazide.
What is the SMILES notation for 2-(3,4-difluorophenoxy)pentanehydrazide?
The canonical SMILES for 2-(3,4-difluorophenoxy)pentanehydrazide is CCCC(Oc1ccc(F)c(F)c1)C(=O)NN.
What is the InChIKey of 2-(3,4-difluorophenoxy)pentanehydrazide?
The InChIKey is BLISUJRFJPZXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O2/c1-2-3-10(11(16)15-14)17-7-4-5-8(12)9(13)6-7/h4-6,10H,2-3,14H2,1H3,(H,15,16).
What are the key properties of 2-(3,4-difluorophenoxy)pentanehydrazide?
2-(3,4-difluorophenoxy)pentanehydrazide has a molecular weight of 244.24 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenoxy)pentanehydrazide is sourced from PubChem (CID 83048019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).