N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide

C14H10F2N2O3 — CID 797948

IUPACN-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1
InChIInChI=1S/C14H10F2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-11-5-6-12(16)13(8-11)18(20)21/h1-6,8H,7H2,(H,17,19)
InChIKeyMWEDWXZDTKDLFI-UHFFFAOYSA-N
MW292.24 g/mol
LogP3.05
Rot. Bonds4

About N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide

N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (PubChem CID 797948) has the molecular formula C14H10F2N2O3 and a molecular weight of 292.24 g/mol. Its IUPAC name is N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
PubChem CID797948
Molecular FormulaC14H10F2N2O3
Molecular Weight292.24 g/mol
Exact Mass292.07
IUPAC NameN-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1
InChIInChI=1S/C14H10F2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-11-5-6-12(16)13(8-11)18(20)21/h1-6,8H,7H2,(H,17,19)
InChIKeyMWEDWXZDTKDLFI-UHFFFAOYSA-N
XLogP3.05
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.24
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', '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-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (CID 797948) is N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is MWEDWXZDTKDLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-11-5-6-12(16)13(8-11)18(20)21/h1-6,8H,7H2,(H,17,19).
What are the key properties of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 292.24 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 797948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).