N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide

C18H13FN2O3 — CID 2797370

IUPACN-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1C(=O)Nc1ccc(F)cc1)c1ccco1
InChIInChI=1S/C18H13FN2O3/c19-12-7-9-13(10-8-12)20-17(22)14-4-1-2-5-15(14)21-18(23)16-6-3-11-24-16/h1-11H,(H,20,22)(H,21,23)
InChIKeyYIMLRNNRCZOUHW-UHFFFAOYSA-N
MW324.31 g/mol
LogP3.92
Rot. Bonds4

About N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide

N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 2797370) has the molecular formula C18H13FN2O3 and a molecular weight of 324.31 g/mol. Its IUPAC name is N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID2797370
Molecular FormulaC18H13FN2O3
Molecular Weight324.31 g/mol
Exact Mass324.09
IUPAC NameN-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1C(=O)Nc1ccc(F)cc1)c1ccco1
InChIInChI=1S/C18H13FN2O3/c19-12-7-9-13(10-8-12)20-17(22)14-4-1-2-5-15(14)21-18(23)16-6-3-11-24-16/h1-11H,(H,20,22)(H,21,23)
InChIKeyYIMLRNNRCZOUHW-UHFFFAOYSA-N
XLogP3.92
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.31
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-Phenyl-2-furancarboxamide
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Mls003171585
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N-(3-fluorophenyl)furan-2-carboxamide
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N-(4-fluorophenyl)-1-benzofuran-2-carboxamide
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(E)-N-(2-methyl-4-(o-tolyldiazenyl)phenyl)furan-2-carboxamide
CID 2827423
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N-(4-Fluorophenyl)-2-furamide
CID 531893

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide (CID 2797370) is N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide is O=C(Nc1ccccc1C(=O)Nc1ccc(F)cc1)c1ccco1.
What is the InChIKey of N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is YIMLRNNRCZOUHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN2O3/c19-12-7-9-13(10-8-12)20-17(22)14-4-1-2-5-15(14)21-18(23)16-6-3-11-24-16/h1-11H,(H,20,22)(H,21,23).
What are the key properties of N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 324.31 g/mol, XLogP of 3.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-fluorophenyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 2797370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).