N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide

C12H9F2NO2 — CID 82820386

IUPACN-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2ccco2)c1F
InChIInChI=1S/C12H9F2NO2/c1-7-4-5-8(13)11(10(7)14)15-12(16)9-3-2-6-17-9/h2-6H,1H3,(H,15,16)
InChIKeyGMYQXEFHYXQJEF-UHFFFAOYSA-N
MW237.21 g/mol
LogP3.12
Rot. Bonds2

About N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide

N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide (PubChem CID 82820386) has the molecular formula C12H9F2NO2 and a molecular weight of 237.21 g/mol. Its IUPAC name is N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide
PubChem CID82820386
Molecular FormulaC12H9F2NO2
Molecular Weight237.21 g/mol
Exact Mass237.06
IUPAC NameN-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2ccco2)c1F
InChIInChI=1S/C12H9F2NO2/c1-7-4-5-8(13)11(10(7)14)15-12(16)9-3-2-6-17-9/h2-6H,1H3,(H,15,16)
InChIKeyGMYQXEFHYXQJEF-UHFFFAOYSA-N
XLogP3.12
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-fluoro-2-methylphenyl)furan-2-carboxamide
CID 4275844
N-(2,6-difluoro-3-methylphenyl)benzamide
CID 82819371
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
N-(5-bromo-4-fluoro-2-methylphenyl)furan-2-carboxamide
CID 103274678
N-(2,5-difluorophenyl)furan-2-carboxamide
CID 2711385
N-(2-bromo-4,6-difluorophenyl)furan-2-carboxamide
CID 1244098
N-[2-(2,6-difluoroanilino)-2-oxoethyl]furan-2-carboxamide
CID 110698062
N-(2,6-difluoro-3-methylphenyl)-3-hydroxy-2-methylbenzamide
CID 82829913
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[5-[(2-fluoro-4-methylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 26665761
N-[4-[(2-fluoro-5-methylphenyl)carbamothioylamino]phenyl]furan-2-carboxamide
CID 53364827

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide?
The IUPAC name of N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide (CID 82820386) is N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide is Cc1ccc(F)c(NC(=O)c2ccco2)c1F.
What is the InChIKey of N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide?
The InChIKey is GMYQXEFHYXQJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO2/c1-7-4-5-8(13)11(10(7)14)15-12(16)9-3-2-6-17-9/h2-6H,1H3,(H,15,16).
What are the key properties of N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide?
N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide has a molecular weight of 237.21 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-3-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 82820386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).