4-(2,4-difluorophenoxy)pentanehydrazide

C11H14F2N2O2 — CID 63575446

IUPAC4-(2,4-difluorophenoxy)pentanehydrazide
SMILESCC(CCC(=O)NN)Oc1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2O2/c1-7(2-5-11(16)15-14)17-10-4-3-8(12)6-9(10)13/h3-4,6-7H,2,5,14H2,1H3,(H,15,16)
InChIKeyDQSSSGFXZOBKJH-UHFFFAOYSA-N
MW244.24 g/mol
LogP1.50
Rot. Bonds5

About 4-(2,4-difluorophenoxy)pentanehydrazide

4-(2,4-difluorophenoxy)pentanehydrazide (PubChem CID 63575446) has the molecular formula C11H14F2N2O2 and a molecular weight of 244.24 g/mol. Its IUPAC name is 4-(2,4-difluorophenoxy)pentanehydrazide.

Molecular Properties

Compound Name4-(2,4-difluorophenoxy)pentanehydrazide
PubChem CID63575446
Molecular FormulaC11H14F2N2O2
Molecular Weight244.24 g/mol
Exact Mass244.10
IUPAC Name4-(2,4-difluorophenoxy)pentanehydrazide
SMILESCC(CCC(=O)NN)Oc1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2O2/c1-7(2-5-11(16)15-14)17-10-4-3-8(12)6-9(10)13/h3-4,6-7H,2,5,14H2,1H3,(H,15,16)
InChIKeyDQSSSGFXZOBKJH-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

4-(3-fluorophenoxy)pentanehydrazide
CID 63575496
4-(2-bromo-4-chlorophenoxy)pentanehydrazide
CID 63575506
4-(2-chlorophenoxy)pentanehydrazide
CID 63574443
4-(4-bromo-2-chlorophenoxy)pentanehydrazide
CID 63574538
methyl 2-(2,4-difluorophenoxy)propanoate
CID 4507460
methyl (2R)-2-(2,4-difluorophenoxy)propanoate
CID 40645997
4-(4-acetyl-2-methoxyphenoxy)pentanehydrazide
CID 63575469
(2S)-2-(2,4-difluorophenoxy)propanoic acid
CID 7268787
N-[2-(2,4-difluorophenoxy)propyl]-2-methylpropan-1-amine
CID 62450002
4-(4-methylsulfanylphenoxy)pentanehydrazide
CID 55246737
3-(2,4-difluorophenoxy)butanimidamide
CID 114995388
1-(3-fluoro-4-pentan-2-yloxyphenyl)ethanone
CID 21105303

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenoxy)pentanehydrazide?
The IUPAC name of 4-(2,4-difluorophenoxy)pentanehydrazide (CID 63575446) is 4-(2,4-difluorophenoxy)pentanehydrazide.
What is the SMILES notation for 4-(2,4-difluorophenoxy)pentanehydrazide?
The canonical SMILES for 4-(2,4-difluorophenoxy)pentanehydrazide is CC(CCC(=O)NN)Oc1ccc(F)cc1F.
What is the InChIKey of 4-(2,4-difluorophenoxy)pentanehydrazide?
The InChIKey is DQSSSGFXZOBKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O2/c1-7(2-5-11(16)15-14)17-10-4-3-8(12)6-9(10)13/h3-4,6-7H,2,5,14H2,1H3,(H,15,16).
What are the key properties of 4-(2,4-difluorophenoxy)pentanehydrazide?
4-(2,4-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 4-(2,4-difluorophenoxy)pentanehydrazide is sourced from PubChem (CID 63575446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).