N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide

C16H9FN2O2 — CID 79953678

IUPACN-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESN#Cc1cc(F)ccc1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C16H9FN2O2/c17-12-5-6-13(11(7-12)9-18)19-16(20)15-8-10-3-1-2-4-14(10)21-15/h1-8H,(H,19,20)
InChIKeyGQBGAEHKGMNVKX-UHFFFAOYSA-N
MW280.26 g/mol
LogP3.70
Rot. Bonds2

About N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide

N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide (PubChem CID 79953678) has the molecular formula C16H9FN2O2 and a molecular weight of 280.26 g/mol. Its IUPAC name is N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide
PubChem CID79953678
Molecular FormulaC16H9FN2O2
Molecular Weight280.26 g/mol
Exact Mass280.06
IUPAC NameN-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESN#Cc1cc(F)ccc1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C16H9FN2O2/c17-12-5-6-13(11(7-12)9-18)19-16(20)15-8-10-3-1-2-4-14(10)21-15/h1-8H,(H,19,20)
InChIKeyGQBGAEHKGMNVKX-UHFFFAOYSA-N
XLogP3.70
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.26
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyano-4-fluorophenyl)-5-methylfuran-2-carboxamide
CID 79954179
N-(2-cyano-4-fluorophenyl)-1-benzothiophene-2-carboxamide
CID 79954172
3,4-bis(1-benzofuran-2-carbonylamino)benzoic acid
CID 17296766
3-(1-benzofuran-2-carbonylamino)-4-fluorobenzoic acid
CID 75414482
N-(2-cyano-4-fluorophenyl)-5-iodothiophene-3-carboxamide
CID 79954178
N-(2-cyano-4-fluorophenyl)-4-iodobenzamide
CID 79952957
N-(2-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24697022
N-(2-cyano-4-fluorophenyl)furan-3-carboxamide
CID 79954360
4-chloro-N-(2-cyano-4-fluorophenyl)benzamide
CID 79946601
N-(2-cyano-4-fluorophenyl)-4-methylbenzamide
CID 79947423
N-(2-phenylphenyl)-1-benzofuran-2-carboxamide
CID 2473887
N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide
CID 81315294

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide (CID 79953678) is N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide is N#Cc1cc(F)ccc1NC(=O)c1cc2ccccc2o1.
What is the InChIKey of N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is GQBGAEHKGMNVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9FN2O2/c17-12-5-6-13(11(7-12)9-18)19-16(20)15-8-10-3-1-2-4-14(10)21-15/h1-8H,(H,19,20).
What are the key properties of N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide?
N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 280.26 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-4-fluorophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 79953678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).