5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide

C21H19Cl2NO2 — CID 44607580

IUPAC5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C21H19Cl2NO2/c1-3-13-6-5-7-14(4-2)20(13)24-21(25)19-11-10-18(26-19)16-12-15(22)8-9-17(16)23/h5-12H,3-4H2,1-2H3,(H,24,25)
InChIKeyXECIGFKOOKPZGH-UHFFFAOYSA-N
MW388.29 g/mol
LogP6.63
Rot. Bonds5

About 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide

5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide (PubChem CID 44607580) has the molecular formula C21H19Cl2NO2 and a molecular weight of 388.29 g/mol. Its IUPAC name is 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide
PubChem CID44607580
Molecular FormulaC21H19Cl2NO2
Molecular Weight388.29 g/mol
Exact Mass387.08
IUPAC Name5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C21H19Cl2NO2/c1-3-13-6-5-7-14(4-2)20(13)24-21(25)19-11-10-18(26-19)16-12-15(22)8-9-17(16)23/h5-12H,3-4H2,1-2H3,(H,24,25)
InChIKeyXECIGFKOOKPZGH-UHFFFAOYSA-N
XLogP6.63
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.29
LogP ≤ 56.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-chlorophenyl)-N-(4-(morpholinomethyl)phenyl)furan-2-carboxamide
CID 2011756
N-(4-(aminomethyl)-2,6-dimethylphenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 53358422
N-(3-chloro-4-methylphenyl)-1-benzofuran-2-carboxamide
CID 785460
N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
CID 1090755
5-(4-chlorophenyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-2-furancarboxamide
CID 1494312
5-(4-Chlorophenyl)-N-(5-(cyclopropylcarbamoyl)-2-methylphenyl)furan-2-carboxamide
CID 59761390
5-(4-chlorophenyl)-N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 17497048
5-(2-Chlorophenyl)-N-phenyl-2-furamide
CID 1351262
5-(2-Chlorophenyl)-N-(4-methoxyphenyl)-2-furamide
CID 4493565
5-(2-Chlorophenyl)-N-(2-ethyl-6-methylphenyl)-2-furamide
CID 7275219
5-(2-Chlorophenyl)-N-(4-fluorophenyl)-2-furamide
CID 944058
N-(2-benzoyl-4-chlorophenyl)furan-2-carboxamide
CID 669415

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide?
The IUPAC name of 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide (CID 44607580) is 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide is CCc1cccc(CC)c1NC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1.
What is the InChIKey of 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide?
The InChIKey is XECIGFKOOKPZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19Cl2NO2/c1-3-13-6-5-7-14(4-2)20(13)24-21(25)19-11-10-18(26-19)16-12-15(22)8-9-17(16)23/h5-12H,3-4H2,1-2H3,(H,24,25).
What are the key properties of 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide?
5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide has a molecular weight of 388.29 g/mol, XLogP of 6.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dichlorophenyl)-N-(2,6-diethylphenyl)furan-2-carboxamide is sourced from PubChem (CID 44607580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).