N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide

C17H12Cl2N2O2 — CID 91689055

IUPACN-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide
SMILESNc1cccc(Cl)c1NC(=O)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H12Cl2N2O2/c18-11-6-4-10(5-7-11)14-8-9-15(23-14)17(22)21-16-12(19)2-1-3-13(16)20/h1-9H,20H2,(H,21,22)
InChIKeyGZVFMSXHELOPER-UHFFFAOYSA-N
MW347.20 g/mol
LogP5.09
Rot. Bonds3

About N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide

N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide (PubChem CID 91689055) has the molecular formula C17H12Cl2N2O2 and a molecular weight of 347.20 g/mol. Its IUPAC name is N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide
PubChem CID91689055
Molecular FormulaC17H12Cl2N2O2
Molecular Weight347.20 g/mol
Exact Mass346.03
IUPAC NameN-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide
SMILESNc1cccc(Cl)c1NC(=O)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H12Cl2N2O2/c18-11-6-4-10(5-7-11)14-8-9-15(23-14)17(22)21-16-12(19)2-1-3-13(16)20/h1-9H,20H2,(H,21,22)
InChIKeyGZVFMSXHELOPER-UHFFFAOYSA-N
XLogP5.09
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.20
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)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

N-(2-amino-6-chlorophenyl)-2-(4-chlorophenyl)acetamide
CID 62085159
N,5-bis(4-chlorophenyl)furan-2-carboxamide
CID 781867
5-(4-chlorophenyl)-N-(2,4,5-trichlorophenyl)furan-2-carboxamide
CID 23995235
5-(4-chlorophenyl)-N-hydroxyfuran-2-carboxamide
CID 91678227
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
5-(4-chlorophenyl)-N-pyridin-3-ylfuran-2-carboxamide
CID 780278
5-(4-chlorophenyl)-N-(2,3,4-trifluorophenyl)furan-2-carboxamide
CID 43029737
5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide
CID 18208546
N-(2-amino-4-chlorophenyl)-5-(2,3-dichlorophenyl)furan-2-carboxamide
CID 91687558
N-(5-chloro-2-methylphenyl)-5-(4-chlorophenyl)furan-2-carboxamide
CID 4873369
N-(2-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 3436050
N-(2-amino-6-chlorophenyl)-2-bromo-4-chlorobenzamide
CID 107986320

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide?
The IUPAC name of N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide (CID 91689055) is N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide is Nc1cccc(Cl)c1NC(=O)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide?
The InChIKey is GZVFMSXHELOPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O2/c18-11-6-4-10(5-7-11)14-8-9-15(23-14)17(22)21-16-12(19)2-1-3-13(16)20/h1-9H,20H2,(H,21,22).
What are the key properties of N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide?
N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide has a molecular weight of 347.20 g/mol, XLogP of 5.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-6-chlorophenyl)-5-(4-chlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 91689055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).