N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide

C18H14Br2N2O2 — CID 91687510

IUPACN-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide
SMILESCc1ccc(-c2ccc(C(=O)Nc3ccc(Br)cc3N)o2)c(Br)c1
InChIInChI=1S/C18H14Br2N2O2/c1-10-2-4-12(13(20)8-10)16-6-7-17(24-16)18(23)22-15-5-3-11(19)9-14(15)21/h2-9H,21H2,1H3,(H,22,23)
InChIKeyZFBYWBVNTYBKHV-UHFFFAOYSA-N
MW450.13 g/mol
LogP5.61
Rot. Bonds3

About N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide

N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide (PubChem CID 91687510) has the molecular formula C18H14Br2N2O2 and a molecular weight of 450.13 g/mol. Its IUPAC name is N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide
PubChem CID91687510
Molecular FormulaC18H14Br2N2O2
Molecular Weight450.13 g/mol
Exact Mass447.94
IUPAC NameN-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide
SMILESCc1ccc(-c2ccc(C(=O)Nc3ccc(Br)cc3N)o2)c(Br)c1
InChIInChI=1S/C18H14Br2N2O2/c1-10-2-4-12(13(20)8-10)16-6-7-17(24-16)18(23)22-15-5-3-11(19)9-14(15)21/h2-9H,21H2,1H3,(H,22,23)
InChIKeyZFBYWBVNTYBKHV-UHFFFAOYSA-N
XLogP5.61
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.13
LogP ≤ 55.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)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-4-bromophenyl)-5-(2-bromophenyl)furan-2-carboxamide
CID 91687442
N-(3-amino-4-methylphenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide
CID 100817322
N-(2-amino-4-bromophenyl)-5-(3-chloro-2-methylphenyl)furan-2-carboxamide
CID 91687495
5-(2-bromo-4-methylphenyl)furan-2-carbohydrazide
CID 50879311
N-(2-amino-4-bromophenyl)-5-methylfuran-2-carboxamide
CID 43130501
N-(3-aminophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide
CID 100817326
N-(2-amino-4-methylphenyl)-5-methylfuran-2-carboxamide
CID 43259016
N-(5-amino-2-methylphenyl)-5-(2-bromo-4-chlorophenyl)furan-2-carboxamide
CID 100817426
N-(4-bromo-2-fluorophenyl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 2238913
N-(4-amino-2-bromo-6-methylphenyl)-5-(4-bromo-2-fluorophenyl)furan-2-carboxamide
CID 100816699
N-(2-amino-4-bromophenyl)-2-hydroxy-4-methylbenzamide
CID 29008265
N-(4-amino-2-bromo-6-methylphenyl)-5-(2-bromo-4-chlorophenyl)furan-2-carboxamide
CID 100816695

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide?
The IUPAC name of N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide (CID 91687510) is N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide is Cc1ccc(-c2ccc(C(=O)Nc3ccc(Br)cc3N)o2)c(Br)c1.
What is the InChIKey of N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide?
The InChIKey is ZFBYWBVNTYBKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Br2N2O2/c1-10-2-4-12(13(20)8-10)16-6-7-17(24-16)18(23)22-15-5-3-11(19)9-14(15)21/h2-9H,21H2,1H3,(H,22,23).
What are the key properties of N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide?
N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide has a molecular weight of 450.13 g/mol, XLogP of 5.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-bromophenyl)-5-(2-bromo-4-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 91687510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).