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

C15H13FN2O4 — CID 3377488

IUPACN-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1
InChIInChI=1S/C15H13FN2O4/c1-22-14-5-3-2-4-10(14)8-15(19)17-11-6-7-12(16)13(9-11)18(20)21/h2-7,9H,8H2,1H3,(H,17,19)
InChIKeyADDLHHJOVHOGFB-UHFFFAOYSA-N
MW304.28 g/mol
LogP2.92
Rot. Bonds5

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

N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide (PubChem CID 3377488) has the molecular formula C15H13FN2O4 and a molecular weight of 304.28 g/mol. Its IUPAC name is N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide
PubChem CID3377488
Molecular FormulaC15H13FN2O4
Molecular Weight304.28 g/mol
Exact Mass304.09
IUPAC NameN-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1
InChIInChI=1S/C15H13FN2O4/c1-22-14-5-3-2-4-10(14)8-15(19)17-11-6-7-12(16)13(9-11)18(20)21/h2-7,9H,8H2,1H3,(H,17,19)
InChIKeyADDLHHJOVHOGFB-UHFFFAOYSA-N
XLogP2.92
TPSA81.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.28
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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Related Compounds

N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
CID 797948
N-(4-fluoro-3-nitrophenyl)-2-(2-fluorophenoxy)acetamide
CID 7478517
2-(2-methoxyphenyl)-N-(2-nitrophenyl)acetamide
CID 3253389
[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3-methoxynaphthalene-2-carboxylate
CID 2715742
[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 2-(2-methoxyphenyl)acetate
CID 40661980
N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide
CID 3375188
N-(4-fluoro-3-nitrophenyl)-2-(3-methoxyphenoxy)acetamide
CID 112787411
2-O-[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 1-O-methyl benzene-1,2-dicarboxylate
CID 56505500
N-(4-methoxy-3-methylphenyl)-2-(2-methoxyphenyl)acetamide
CID 110776428
N-(3-bromo-4-fluorophenyl)-2-(2-nitrophenyl)acetamide
CID 115661368
N,N'-bis(4-fluoro-3-nitrophenyl)pentanediamide
CID 4303961
N-(4-fluoro-3-nitrophenyl)-2-(2-phenylphenoxy)acetamide
CID 9212015

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide (CID 3377488) is N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide is COc1ccccc1CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
The InChIKey is ADDLHHJOVHOGFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O4/c1-22-14-5-3-2-4-10(14)8-15(19)17-11-6-7-12(16)13(9-11)18(20)21/h2-7,9H,8H2,1H3,(H,17,19).
What are the key properties of N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide?
N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide has a molecular weight of 304.28 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-nitrophenyl)-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 3377488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).