N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide

C20H18FNO3 — CID 16650861

IUPACN-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)oc1C
InChIInChI=1S/C20H18FNO3/c1-3-24-18-7-5-4-6-17(18)22-20(23)16-12-19(25-13(16)2)14-8-10-15(21)11-9-14/h4-12H,3H2,1-2H3,(H,22,23)
InChIKeyAARMSQHLCLORNJ-UHFFFAOYSA-N
MW339.37 g/mol
LogP5.05
Rot. Bonds5

About N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide

N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide (PubChem CID 16650861) has the molecular formula C20H18FNO3 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
PubChem CID16650861
Molecular FormulaC20H18FNO3
Molecular Weight339.37 g/mol
Exact Mass339.13
IUPAC NameN-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)oc1C
InChIInChI=1S/C20H18FNO3/c1-3-24-18-7-5-4-6-17(18)22-20(23)16-12-19(25-13(16)2)14-8-10-15(21)11-9-14/h4-12H,3H2,1-2H3,(H,22,23)
InChIKeyAARMSQHLCLORNJ-UHFFFAOYSA-N
XLogP5.05
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.37
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide
CID 16650745
ethyl 2-[[5-(4-chlorophenyl)-2-methylfuran-3-carbonyl]amino]benzoate
CID 16651463
2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
CID 2591172
N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206274
N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
N-(2-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380223
N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 2742876
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647
N-(2-ethoxyphenyl)-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 9192368
N-(2-ethoxyphenyl)-2-iodobenzamide
CID 996130
N-(2-ethoxyphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 42352848
2-ethoxy-N-(2-fluorophenyl)benzamide
CID 773674

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide (CID 16650861) is N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide is CCOc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)oc1C.
What is the InChIKey of N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The InChIKey is AARMSQHLCLORNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO3/c1-3-24-18-7-5-4-6-17(18)22-20(23)16-12-19(25-13(16)2)14-8-10-15(21)11-9-14/h4-12H,3H2,1-2H3,(H,22,23).
What are the key properties of N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide has a molecular weight of 339.37 g/mol, XLogP of 5.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 16650861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).