5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide

C15H8Cl3NO2 — CID 19240955

IUPAC5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C15H8Cl3NO2/c16-9-1-2-13-8(3-9)4-14(21-13)15(20)19-12-6-10(17)5-11(18)7-12/h1-7H,(H,19,20)
InChIKeyPNBMVQDVKKBESF-UHFFFAOYSA-N
MW340.59 g/mol
LogP5.65
Rot. Bonds2

About 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide

5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide (PubChem CID 19240955) has the molecular formula C15H8Cl3NO2 and a molecular weight of 340.59 g/mol. Its IUPAC name is 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
PubChem CID19240955
Molecular FormulaC15H8Cl3NO2
Molecular Weight340.59 g/mol
Exact Mass338.96
IUPAC Name5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C15H8Cl3NO2/c16-9-1-2-13-8(3-9)4-14(21-13)15(20)19-12-6-10(17)5-11(18)7-12/h1-7H,(H,19,20)
InChIKeyPNBMVQDVKKBESF-UHFFFAOYSA-N
XLogP5.65
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.59
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide
CID 18876031
5-chloro-N-(2,6-difluorophenyl)-1-benzofuran-2-carboxamide
CID 51217226
N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide
CID 110476557
5-chloro-N-(4-chloro-2-methylphenyl)-1-benzofuran-2-carboxamide
CID 9138973
N-(4-chlorophenyl)-5-fluoro-1-benzofuran-2-carboxamide
CID 78843309
5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
CID 134019812
5-chloro-N-(2-fluorophenyl)-1-benzofuran-2-carboxamide
CID 9138991
6-chloro-N-(3,5-dichlorophenyl)-2-iminochromene-3-carboxamide
CID 17373603
5-chloro-N-[4-(dimethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 9328773
N-tert-butyl-5-chloro-1-benzofuran-2-carboxamide
CID 19240925
propyl 4-[(5-chloro-1-benzofuran-2-carbonyl)amino]benzoate
CID 19240947
5-chloro-N-(1,3-thiazol-2-yl)-1-benzofuran-2-carboxamide
CID 9138749

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide (CID 19240955) is 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is PNBMVQDVKKBESF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl3NO2/c16-9-1-2-13-8(3-9)4-14(21-13)15(20)19-12-6-10(17)5-11(18)7-12/h1-7H,(H,19,20).
What are the key properties of 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide?
5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 340.59 g/mol, XLogP of 5.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 19240955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).