5-bromofuro[2,3-c]pyridine-2-carboxamide

C8H5BrN2O2 — CID 172599017

IUPAC5-bromofuro[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2cc(Br)ncc2o1
InChIInChI=1S/C8H5BrN2O2/c9-7-2-4-1-5(8(10)12)13-6(4)3-11-7/h1-3H,(H2,10,12)
InChIKeyUCOVSFIGSZWJJL-UHFFFAOYSA-N
MW241.04 g/mol
LogP1.69
Rot. Bonds1

About 5-bromofuro[2,3-c]pyridine-2-carboxamide

5-bromofuro[2,3-c]pyridine-2-carboxamide (PubChem CID 172599017) has the molecular formula C8H5BrN2O2 and a molecular weight of 241.04 g/mol. Its IUPAC name is 5-bromofuro[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromofuro[2,3-c]pyridine-2-carboxamide
PubChem CID172599017
Molecular FormulaC8H5BrN2O2
Molecular Weight241.04 g/mol
Exact Mass239.95
IUPAC Name5-bromofuro[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2cc(Br)ncc2o1
InChIInChI=1S/C8H5BrN2O2/c9-7-2-4-1-5(8(10)12)13-6(4)3-11-7/h1-3H,(H2,10,12)
InChIKeyUCOVSFIGSZWJJL-UHFFFAOYSA-N
XLogP1.69
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.04
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-bromofuro[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 5-bromofuro[2,3-c]pyridine-2-carboxamide (CID 172599017) is 5-bromofuro[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 5-bromofuro[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 5-bromofuro[2,3-c]pyridine-2-carboxamide is NC(=O)c1cc2cc(Br)ncc2o1.
What is the InChIKey of 5-bromofuro[2,3-c]pyridine-2-carboxamide?
The InChIKey is UCOVSFIGSZWJJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrN2O2/c9-7-2-4-1-5(8(10)12)13-6(4)3-11-7/h1-3H,(H2,10,12).
What are the key properties of 5-bromofuro[2,3-c]pyridine-2-carboxamide?
5-bromofuro[2,3-c]pyridine-2-carboxamide has a molecular weight of 241.04 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromofuro[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 172599017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).