5-bromo-2-ethenylfuran-3-carboxamide

C7H6BrNO2 — CID 173465848

IUPAC5-bromo-2-ethenylfuran-3-carboxamide
SMILESC=Cc1oc(Br)cc1C(N)=O
InChIInChI=1S/C7H6BrNO2/c1-2-5-4(7(9)10)3-6(8)11-5/h2-3H,1H2,(H2,9,10)
InChIKeyZGMONLQMDZJHEA-UHFFFAOYSA-N
MW216.03 g/mol
LogP1.78
Rot. Bonds2

About 5-bromo-2-ethenylfuran-3-carboxamide

5-bromo-2-ethenylfuran-3-carboxamide (PubChem CID 173465848) has the molecular formula C7H6BrNO2 and a molecular weight of 216.03 g/mol. Its IUPAC name is 5-bromo-2-ethenylfuran-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-ethenylfuran-3-carboxamide
PubChem CID173465848
Molecular FormulaC7H6BrNO2
Molecular Weight216.03 g/mol
Exact Mass214.96
IUPAC Name5-bromo-2-ethenylfuran-3-carboxamide
SMILESC=Cc1oc(Br)cc1C(N)=O
InChIInChI=1S/C7H6BrNO2/c1-2-5-4(7(9)10)3-6(8)11-5/h2-3H,1H2,(H2,9,10)
InChIKeyZGMONLQMDZJHEA-UHFFFAOYSA-N
XLogP1.78
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.03
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-2-ethenylfuran-3-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-bromo-2-ethenylfuran-3-carboxamide?
The IUPAC name of 5-bromo-2-ethenylfuran-3-carboxamide (CID 173465848) is 5-bromo-2-ethenylfuran-3-carboxamide.
What is the SMILES notation for 5-bromo-2-ethenylfuran-3-carboxamide?
The canonical SMILES for 5-bromo-2-ethenylfuran-3-carboxamide is C=Cc1oc(Br)cc1C(N)=O.
What is the InChIKey of 5-bromo-2-ethenylfuran-3-carboxamide?
The InChIKey is ZGMONLQMDZJHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrNO2/c1-2-5-4(7(9)10)3-6(8)11-5/h2-3H,1H2,(H2,9,10).
What are the key properties of 5-bromo-2-ethenylfuran-3-carboxamide?
5-bromo-2-ethenylfuran-3-carboxamide has a molecular weight of 216.03 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-ethenylfuran-3-carboxamide is sourced from PubChem (CID 173465848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).