N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide

C15H14FN3O3 — CID 174480545

IUPACN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)Nc1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C15H14FN3O3/c16-11-3-1-2-10(8-11)9-22-13-6-4-12(5-7-13)18-14(20)15(21)19-17/h1-8H,9,17H2,(H,18,20)(H,19,21)
InChIKeyYTJSINBXZSCGED-UHFFFAOYSA-N
MW303.29 g/mol
LogP1.33
Rot. Bonds4

About N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide

N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide (PubChem CID 174480545) has the molecular formula C15H14FN3O3 and a molecular weight of 303.29 g/mol. Its IUPAC name is N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide.

Molecular Properties

Compound NameN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide
PubChem CID174480545
Molecular FormulaC15H14FN3O3
Molecular Weight303.29 g/mol
Exact Mass303.10
IUPAC NameN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)Nc1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C15H14FN3O3/c16-11-3-1-2-10(8-11)9-22-13-6-4-12(5-7-13)18-14(20)15(21)19-17/h1-8H,9,17H2,(H,18,20)(H,19,21)
InChIKeyYTJSINBXZSCGED-UHFFFAOYSA-N
XLogP1.33
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.29
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide?
The IUPAC name of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide (CID 174480545) is N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide.
What is the SMILES notation for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide?
The canonical SMILES for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide is NNC(=O)C(=O)Nc1ccc(OCc2cccc(F)c2)cc1.
What is the InChIKey of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide?
The InChIKey is YTJSINBXZSCGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O3/c16-11-3-1-2-10(8-11)9-22-13-6-4-12(5-7-13)18-14(20)15(21)19-17/h1-8H,9,17H2,(H,18,20)(H,19,21).
What are the key properties of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide?
N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide has a molecular weight of 303.29 g/mol, XLogP of 1.33, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-hydrazinyl-2-oxoacetamide is sourced from PubChem (CID 174480545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).