2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide

C13H11FN2O3 — CID 5368979

IUPAC2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
SMILESO=C(COc1ccc(F)cc1)N/N=C\c1ccco1
InChIInChI=1S/C13H11FN2O3/c14-10-3-5-11(6-4-10)19-9-13(17)16-15-8-12-2-1-7-18-12/h1-8H,9H2,(H,16,17)/b15-8-
InChIKeyXSPUNVPURIIVQU-NVNXTCNLSA-N
MW262.24 g/mol
LogP1.95
Rot. Bonds5

About 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide

2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide (PubChem CID 5368979) has the molecular formula C13H11FN2O3 and a molecular weight of 262.24 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
PubChem CID5368979
Molecular FormulaC13H11FN2O3
Molecular Weight262.24 g/mol
Exact Mass262.08
IUPAC Name2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
SMILESO=C(COc1ccc(F)cc1)N/N=C\c1ccco1
InChIInChI=1S/C13H11FN2O3/c14-10-3-5-11(6-4-10)19-9-13(17)16-15-8-12-2-1-7-18-12/h1-8H,9H2,(H,16,17)/b15-8-
InChIKeyXSPUNVPURIIVQU-NVNXTCNLSA-N
XLogP1.95
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.24
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide 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-[(Z)-furan-2-ylmethylideneamino]-2-naphthalen-2-yloxyacetamide
CID 5405073
2-(4-fluoroanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5404241
N-(furan-2-ylmethylideneamino)-2-(2,4,6-trimethylphenoxy)acetamide
CID 832440
(E)-N-[(E)-furan-2-ylmethylideneamino]-N'-[(Z)-furan-2-ylmethylideneamino]hex-3-enediamide
CID 45050499
N-[(E)-(4-fluorophenyl)methylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 6893389
N,N'-bis(furan-2-ylmethylideneamino)decanediamide
CID 5226719
N-(4-ethoxyphenyl)-N'-(furan-2-ylmethylideneamino)butanediamide
CID 3584762
2-(2,4-dimethylphenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 6020779
N-[(E)-furan-2-ylmethylideneamino]-2-(4-iodo-2,6-dimethylphenoxy)acetamide
CID 6040206
2-(4-fluorophenoxy)-N-[(Z)-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methylideneamino]acetamide
CID 9395401
N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide
CID 6896656
N-(furan-2-ylmethylideneamino)-2-[[2-(3-methylphenoxy)acetyl]amino]acetamide
CID 2246608

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide (CID 5368979) is 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide is O=C(COc1ccc(F)cc1)N/N=C\c1ccco1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide?
The InChIKey is XSPUNVPURIIVQU-NVNXTCNLSA-N. The full InChI is InChI=1S/C13H11FN2O3/c14-10-3-5-11(6-4-10)19-9-13(17)16-15-8-12-2-1-7-18-12/h1-8H,9H2,(H,16,17)/b15-8-.
What are the key properties of 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide?
2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide has a molecular weight of 262.24 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide is sourced from PubChem (CID 5368979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).