5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide

C17H10ClFINO2 — CID 2232193

IUPAC5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(I)cc1F)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H10ClFINO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-14-6-5-12(20)9-13(14)19/h1-9H,(H,21,22)
InChIKeyPWYCDBKKWMLRPO-UHFFFAOYSA-N
MW441.63 g/mol
LogP5.60
Rot. Bonds3

About 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide

5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide (PubChem CID 2232193) has the molecular formula C17H10ClFINO2 and a molecular weight of 441.63 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide
PubChem CID2232193
Molecular FormulaC17H10ClFINO2
Molecular Weight441.63 g/mol
Exact Mass440.94
IUPAC Name5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(I)cc1F)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H10ClFINO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-14-6-5-12(20)9-13(14)19/h1-9H,(H,21,22)
InChIKeyPWYCDBKKWMLRPO-UHFFFAOYSA-N
XLogP5.60
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.63
LogP ≤ 55.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-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

5-(4-chlorophenyl)-N-(2,3,4-trifluorophenyl)furan-2-carboxamide
CID 43029737
5-(4-chlorophenyl)-N-(2,4,5-trichlorophenyl)furan-2-carboxamide
CID 23995235
N-(2-fluoro-4-iodophenyl)-5-(3-nitrophenyl)furan-2-carboxamide
CID 2233721
5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide
CID 18208546
N-(5-chloro-2-methylphenyl)-5-(4-chlorophenyl)furan-2-carboxamide
CID 4873369
N,5-bis(4-chlorophenyl)furan-2-carboxamide
CID 781867
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
N-(4-chloro-2-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 9404808
N-(2-chloro-4-iodophenyl)-5-(3,4-dimethylphenyl)furan-2-carboxamide
CID 3580369
5-(4-chlorophenyl)-N-hydroxyfuran-2-carboxamide
CID 91678227
5-(3,4-dichlorophenyl)-N-(2-ethyl-4-iodophenyl)furan-2-carboxamide
CID 17117529
5-(3,4-dimethylphenyl)-N-(4-iodo-2-methylphenyl)furan-2-carboxamide
CID 4309569

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide (CID 2232193) is 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide is O=C(Nc1ccc(I)cc1F)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide?
The InChIKey is PWYCDBKKWMLRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10ClFINO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-14-6-5-12(20)9-13(14)19/h1-9H,(H,21,22).
What are the key properties of 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide?
5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide has a molecular weight of 441.63 g/mol, XLogP of 5.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide is sourced from PubChem (CID 2232193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).