5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide

C17H13Cl2NO4 — CID 19240981

IUPAC5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3cc(Cl)ccc3o2)c(OC)cc1Cl
InChIInChI=1S/C17H13Cl2NO4/c1-22-14-8-12(15(23-2)7-11(14)19)20-17(21)16-6-9-5-10(18)3-4-13(9)24-16/h3-8H,1-2H3,(H,20,21)
InChIKeyNDIKADXDBQSZQS-UHFFFAOYSA-N
MW366.20 g/mol
LogP5.01
Rot. Bonds4

About 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide

5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide (PubChem CID 19240981) has the molecular formula C17H13Cl2NO4 and a molecular weight of 366.20 g/mol. Its IUPAC name is 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide
PubChem CID19240981
Molecular FormulaC17H13Cl2NO4
Molecular Weight366.20 g/mol
Exact Mass365.02
IUPAC Name5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3cc(Cl)ccc3o2)c(OC)cc1Cl
InChIInChI=1S/C17H13Cl2NO4/c1-22-14-8-12(15(23-2)7-11(14)19)20-17(21)16-6-9-5-10(18)3-4-13(9)24-16/h3-8H,1-2H3,(H,20,21)
InChIKeyNDIKADXDBQSZQS-UHFFFAOYSA-N
XLogP5.01
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.20
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-chloro-2,4-dimethoxyphenyl)-1-benzofuran-2-carboxamide
CID 7751403
5-chloro-N-(4-chloro-2-methylphenyl)-1-benzofuran-2-carboxamide
CID 9138973
N-(4-chloro-2-hydroxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide
CID 126194096
5-acetamido-N-(4-chloro-2,5-dimethoxyphenyl)furan-2-carboxamide
CID 110699998
5-chloro-N-(2-fluorophenyl)-1-benzofuran-2-carboxamide
CID 9138991
5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 9269145
6-chloro-N-(5-fluoro-2,4-dimethoxyphenyl)-4-oxochromene-2-carboxamide
CID 99585387
N-(4-chloro-2,5-dimethoxyphenyl)-1,2-oxazole-5-carboxamide
CID 8003045
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502302
5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
CID 19240955
N-(4-bromo-2-methylphenyl)-5-chloro-1-benzofuran-2-carboxamide
CID 9159182
5-chloro-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-1-benzofuran-2-carboxamide
CID 99818760

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide (CID 19240981) is 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide is COc1cc(NC(=O)c2cc3cc(Cl)ccc3o2)c(OC)cc1Cl.
What is the InChIKey of 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide?
The InChIKey is NDIKADXDBQSZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2NO4/c1-22-14-8-12(15(23-2)7-11(14)19)20-17(21)16-6-9-5-10(18)3-4-13(9)24-16/h3-8H,1-2H3,(H,20,21).
What are the key properties of 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide?
5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide has a molecular weight of 366.20 g/mol, XLogP of 5.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 19240981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).