5-(4-bromophenyl)furan-2-carboxamide

C11H8BrNO2 — CID 658747

IUPAC5-(4-bromophenyl)furan-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Br)cc2)o1
InChIInChI=1S/C11H8BrNO2/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14)
InChIKeyXXLMIQGREFEHPT-UHFFFAOYSA-N
MW266.09 g/mol
LogP2.81
Rot. Bonds2

About 5-(4-bromophenyl)furan-2-carboxamide

5-(4-bromophenyl)furan-2-carboxamide (PubChem CID 658747) has the molecular formula C11H8BrNO2 and a molecular weight of 266.09 g/mol. Its IUPAC name is 5-(4-bromophenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-bromophenyl)furan-2-carboxamide
PubChem CID658747
Molecular FormulaC11H8BrNO2
Molecular Weight266.09 g/mol
Exact Mass264.97
IUPAC Name5-(4-bromophenyl)furan-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Br)cc2)o1
InChIInChI=1S/C11H8BrNO2/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14)
InChIKeyXXLMIQGREFEHPT-UHFFFAOYSA-N
XLogP2.81
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.09
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(4-bromophenyl)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

Frequently Asked Questions

What is the IUPAC name of 5-(4-bromophenyl)furan-2-carboxamide?
The IUPAC name of 5-(4-bromophenyl)furan-2-carboxamide (CID 658747) is 5-(4-bromophenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-bromophenyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-bromophenyl)furan-2-carboxamide is NC(=O)c1ccc(-c2ccc(Br)cc2)o1.
What is the InChIKey of 5-(4-bromophenyl)furan-2-carboxamide?
The InChIKey is XXLMIQGREFEHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrNO2/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14).
What are the key properties of 5-(4-bromophenyl)furan-2-carboxamide?
5-(4-bromophenyl)furan-2-carboxamide has a molecular weight of 266.09 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-bromophenyl)furan-2-carboxamide is sourced from PubChem (CID 658747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).