N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide

C15H11FN2O2 — CID 81315294

IUPACN-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESNc1cccc(F)c1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H11FN2O2/c16-10-5-3-6-11(17)14(10)18-15(19)13-8-9-4-1-2-7-12(9)20-13/h1-8H,17H2,(H,18,19)
InChIKeyYPEQLLMITWMEJZ-UHFFFAOYSA-N
MW270.26 g/mol
LogP3.41
Rot. Bonds2

About N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide

N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide (PubChem CID 81315294) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide
PubChem CID81315294
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC NameN-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESNc1cccc(F)c1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H11FN2O2/c16-10-5-3-6-11(17)14(10)18-15(19)13-8-9-4-1-2-7-12(9)20-13/h1-8H,17H2,(H,18,19)
InChIKeyYPEQLLMITWMEJZ-UHFFFAOYSA-N
XLogP3.41
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-(2,6-difluorophenyl)-1-benzofuran-2-carboxamide
CID 51217226
N-(2-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24697022
N-(2,6-difluorophenyl)-2-oxochromene-3-carboxamide
CID 42618006
3-(1-benzofuran-2-carbonylamino)-4-fluorobenzoic acid
CID 75414482
N-(2-amino-4-bromo-6-methylphenyl)-1-benzofuran-2-carboxamide
CID 43549971
N-(3-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24708217
N-(3-bromophenyl)-1-benzofuran-2-carboxamide
CID 802478
N-[3-[(2-aminobenzoyl)amino]propyl]-1-benzofuran-2-carboxamide
CID 41448519
N-(4-iodophenyl)-1-benzofuran-2-carboxamide
CID 986281
N-(4,6-dimethylpyrimidin-2-yl)-1-benzofuran-2-carboxamide
CID 802234
5-chloro-N-(2-fluorophenyl)-1-benzofuran-2-carboxamide
CID 9138991
N-(2-amino-6-chlorophenyl)-5-methyl-1-benzofuran-2-carboxamide
CID 62084978

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide (CID 81315294) is N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide is Nc1cccc(F)c1NC(=O)c1cc2ccccc2o1.
What is the InChIKey of N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is YPEQLLMITWMEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-10-5-3-6-11(17)14(10)18-15(19)13-8-9-4-1-2-7-12(9)20-13/h1-8H,17H2,(H,18,19).
What are the key properties of N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide?
N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 270.26 g/mol, XLogP of 3.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 81315294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).