2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide

C15H15FN2O2 — CID 115465202

IUPAC2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide
SMILESNNC(=O)Cc1ccccc1COc1cccc(F)c1
InChIInChI=1S/C15H15FN2O2/c16-13-6-3-7-14(9-13)20-10-12-5-2-1-4-11(12)8-15(19)18-17/h1-7,9H,8,10,17H2,(H,18,19)
InChIKeyINFAFOTVPKEHPO-UHFFFAOYSA-N
MW274.30 g/mol
LogP1.94
Rot. Bonds5

About 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide

2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide (PubChem CID 115465202) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide.

Molecular Properties

Compound Name2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide
PubChem CID115465202
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide
SMILESNNC(=O)Cc1ccccc1COc1cccc(F)c1
InChIInChI=1S/C15H15FN2O2/c16-13-6-3-7-14(9-13)20-10-12-5-2-1-4-11(12)8-15(19)18-17/h1-7,9H,8,10,17H2,(H,18,19)
InChIKeyINFAFOTVPKEHPO-UHFFFAOYSA-N
XLogP1.94
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 51.94
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'}

Analyze 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide 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

N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
CID 2670466
3-[(3-fluorophenoxy)methyl]furan-2-carbohydrazide
CID 63577037
3-bromo-4-[(3-fluorophenoxy)methyl]benzohydrazide
CID 102774327
2-[2-[(2,6-dibromophenoxy)methyl]phenyl]acetohydrazide
CID 115465209
3-[(3-fluorophenoxy)methyl]benzohydrazide
CID 63576868
3-(3-fluorophenoxy)-2,2-dimethylpropanehydrazide
CID 79626955
2-[(3-iodophenoxy)methyl]benzohydrazide
CID 63576085
2-[2-[(2-methylsulfanylphenoxy)methyl]phenyl]acetohydrazide
CID 115465259
2-[2-(2,2,2-trifluoroethoxymethyl)phenyl]acetohydrazide
CID 115465158
5-amino-2-[(3-fluorophenoxy)methyl]phenol
CID 117219630
3-amino-4-[(3-fluorophenoxy)methyl]benzamide
CID 43376530
4-(3-fluorophenoxy)pentanehydrazide
CID 63575496

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide?
The IUPAC name of 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide (CID 115465202) is 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide.
What is the SMILES notation for 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide?
The canonical SMILES for 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide is NNC(=O)Cc1ccccc1COc1cccc(F)c1.
What is the InChIKey of 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide?
The InChIKey is INFAFOTVPKEHPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-13-6-3-7-14(9-13)20-10-12-5-2-1-4-11(12)8-15(19)18-17/h1-7,9H,8,10,17H2,(H,18,19).
What are the key properties of 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide?
2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide has a molecular weight of 274.30 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(3-fluorophenoxy)methyl]phenyl]acetohydrazide is sourced from PubChem (CID 115465202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).