N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide

C16H11F2NO2 — CID 7770031

IUPACN-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide
SMILESCc1c(C(=O)Nc2ccc(F)cc2F)oc2ccccc12
InChIInChI=1S/C16H11F2NO2/c1-9-11-4-2-3-5-14(11)21-15(9)16(20)19-13-7-6-10(17)8-12(13)18/h2-8H,1H3,(H,19,20)
InChIKeyZFMSWZRFOOQCPW-UHFFFAOYSA-N
MW287.27 g/mol
LogP4.27
Rot. Bonds2

About N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide

N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide (PubChem CID 7770031) has the molecular formula C16H11F2NO2 and a molecular weight of 287.27 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide
PubChem CID7770031
Molecular FormulaC16H11F2NO2
Molecular Weight287.27 g/mol
Exact Mass287.08
IUPAC NameN-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide
SMILESCc1c(C(=O)Nc2ccc(F)cc2F)oc2ccccc12
InChIInChI=1S/C16H11F2NO2/c1-9-11-4-2-3-5-14(11)21-15(9)16(20)19-13-7-6-10(17)8-12(13)18/h2-8H,1H3,(H,19,20)
InChIKeyZFMSWZRFOOQCPW-UHFFFAOYSA-N
XLogP4.27
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.27
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2-fluorophenyl)-5-fluoro-3-methyl-1-benzofuran-2-carboxamide
CID 9344702
N-(4-chloro-2-methylphenyl)-5-fluoro-3-methyl-1-benzofuran-2-carboxamide
CID 9344604
N-(2,4-difluorophenyl)-4-hydroxy-2-oxochromene-3-carboxamide
CID 54737498
N-(5-chloro-2-methylphenyl)-5-fluoro-3-methyl-1-benzofuran-2-carboxamide
CID 9344840
2-[(3-methyl-1-benzofuran-2-carbonyl)amino]benzoate
CID 7463653
N-(2-ethylsulfonylphenyl)-5-fluoro-3-methyl-1-benzofuran-2-carboxamide
CID 55613510
3-methyl-N-(2,4,6-trichlorophenyl)-1-benzofuran-2-carboxamide
CID 108793598
[1-(2,5-difluoroanilino)-1-oxopropan-2-yl] 3-methyl-1-benzofuran-2-carboxylate
CID 55420447
N-(2,5-difluorophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 7770218
N-(4-fluoro-3-nitrophenyl)-3-methyl-1-benzofuran-2-carboxamide
CID 9076846
1-N,2-N-bis(2,4-difluorophenyl)benzene-1,2-dicarboxamide
CID 4062467
3-methyl-N-(2-phenylsulfanylphenyl)-1-benzofuran-2-carboxamide
CID 108793551

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide (CID 7770031) is N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide is Cc1c(C(=O)Nc2ccc(F)cc2F)oc2ccccc12.
What is the InChIKey of N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide?
The InChIKey is ZFMSWZRFOOQCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NO2/c1-9-11-4-2-3-5-14(11)21-15(9)16(20)19-13-7-6-10(17)8-12(13)18/h2-8H,1H3,(H,19,20).
What are the key properties of N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide?
N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide has a molecular weight of 287.27 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 7770031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).