5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide

C11H8Br2N2O2 — CID 1017492

IUPAC5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide
SMILESCc1nc(NC(=O)c2ccc(Br)o2)ccc1Br
InChIInChI=1S/C11H8Br2N2O2/c1-6-7(12)2-5-10(14-6)15-11(16)8-3-4-9(13)17-8/h2-5H,1H3,(H,14,15,16)
InChIKeyRHPDRNTUSRTUGG-UHFFFAOYSA-N
MW360.01 g/mol
LogP3.76
Rot. Bonds2

About 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide

5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide (PubChem CID 1017492) has the molecular formula C11H8Br2N2O2 and a molecular weight of 360.01 g/mol. Its IUPAC name is 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide
PubChem CID1017492
Molecular FormulaC11H8Br2N2O2
Molecular Weight360.01 g/mol
Exact Mass357.90
IUPAC Name5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide
SMILESCc1nc(NC(=O)c2ccc(Br)o2)ccc1Br
InChIInChI=1S/C11H8Br2N2O2/c1-6-7(12)2-5-10(14-6)15-11(16)8-3-4-9(13)17-8/h2-5H,1H3,(H,14,15,16)
InChIKeyRHPDRNTUSRTUGG-UHFFFAOYSA-N
XLogP3.76
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.01
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide (CID 1017492) is 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide is Cc1nc(NC(=O)c2ccc(Br)o2)ccc1Br.
What is the InChIKey of 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide?
The InChIKey is RHPDRNTUSRTUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2N2O2/c1-6-7(12)2-5-10(14-6)15-11(16)8-3-4-9(13)17-8/h2-5H,1H3,(H,14,15,16).
What are the key properties of 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide?
5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide has a molecular weight of 360.01 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(5-bromo-6-methyl-2-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 1017492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).