5-(2,3-difluorophenoxy)pentanehydrazide

C11H14F2N2O2 — CID 63569509

IUPAC5-(2,3-difluorophenoxy)pentanehydrazide
SMILESNNC(=O)CCCCOc1cccc(F)c1F
InChIInChI=1S/C11H14F2N2O2/c12-8-4-3-5-9(11(8)13)17-7-2-1-6-10(16)15-14/h3-5H,1-2,6-7,14H2,(H,15,16)
InChIKeyMWNAWUVDBIEWGU-UHFFFAOYSA-N
MW244.24 g/mol
LogP1.50
Rot. Bonds6

About 5-(2,3-difluorophenoxy)pentanehydrazide

5-(2,3-difluorophenoxy)pentanehydrazide (PubChem CID 63569509) has the molecular formula C11H14F2N2O2 and a molecular weight of 244.24 g/mol. Its IUPAC name is 5-(2,3-difluorophenoxy)pentanehydrazide.

Molecular Properties

Compound Name5-(2,3-difluorophenoxy)pentanehydrazide
PubChem CID63569509
Molecular FormulaC11H14F2N2O2
Molecular Weight244.24 g/mol
Exact Mass244.10
IUPAC Name5-(2,3-difluorophenoxy)pentanehydrazide
SMILESNNC(=O)CCCCOc1cccc(F)c1F
InChIInChI=1S/C11H14F2N2O2/c12-8-4-3-5-9(11(8)13)17-7-2-1-6-10(16)15-14/h3-5H,1-2,6-7,14H2,(H,15,16)
InChIKeyMWNAWUVDBIEWGU-UHFFFAOYSA-N
XLogP1.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-(2,3-difluorophenoxy)pentanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2,3-difluorophenoxy)butanehydrazide
CID 63568959
4-(2,6-difluorophenoxy)butanehydrazide
CID 81268570
1-[7-(2,3-difluorophenoxy)heptoxy]-2,3-difluorobenzene
CID 71446254
5-(2-ethoxyphenoxy)pentanehydrazide
CID 63575982
5-(2-ethylphenoxy)pentanehydrazide
CID 63569442
5-(2,3,4,5,6-pentafluorophenoxy)pentanehydrazide
CID 63570877
4-[2-(2,3-difluorophenoxy)ethoxy]-4-oxobutanoic acid
CID 90124119
6-(5-fluoro-2-methylphenoxy)hexanehydrazide
CID 102987680
4-(2,3-dimethylphenoxy)butanehydrazide
CID 63574436
7-(2-fluorophenoxy)-N-hydroxyheptanamide
CID 39357269
N-[2-(5-hydrazinyl-5-oxopentoxy)phenyl]acetamide
CID 63576193
5-(2-prop-1-enylphenoxy)pentanehydrazide
CID 77002054

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-difluorophenoxy)pentanehydrazide?
The IUPAC name of 5-(2,3-difluorophenoxy)pentanehydrazide (CID 63569509) is 5-(2,3-difluorophenoxy)pentanehydrazide.
What is the SMILES notation for 5-(2,3-difluorophenoxy)pentanehydrazide?
The canonical SMILES for 5-(2,3-difluorophenoxy)pentanehydrazide is NNC(=O)CCCCOc1cccc(F)c1F.
What is the InChIKey of 5-(2,3-difluorophenoxy)pentanehydrazide?
The InChIKey is MWNAWUVDBIEWGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O2/c12-8-4-3-5-9(11(8)13)17-7-2-1-6-10(16)15-14/h3-5H,1-2,6-7,14H2,(H,15,16).
What are the key properties of 5-(2,3-difluorophenoxy)pentanehydrazide?
5-(2,3-difluorophenoxy)pentanehydrazide has a molecular weight of 244.24 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-difluorophenoxy)pentanehydrazide is sourced from PubChem (CID 63569509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).