5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane

C8H10BrClN2O2 — CID 144985918

IUPAC5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane
SMILESCC.NC(=O)c1[nH]c(=O)c(Br)cc1Cl
InChIInChI=1S/C6H4BrClN2O2.C2H6/c7-2-1-3(8)4(5(9)11)10-6(2)12;1-2/h1H,(H2,9,11)(H,10,12);1-2H3
InChIKeyNAMMUEJLMFBZSG-UHFFFAOYSA-N
MW281.54 g/mol
LogP1.92
Rot. Bonds1

About 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane

5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane (PubChem CID 144985918) has the molecular formula C8H10BrClN2O2 and a molecular weight of 281.54 g/mol. Its IUPAC name is 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane.

Molecular Properties

Compound Name5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane
PubChem CID144985918
Molecular FormulaC8H10BrClN2O2
Molecular Weight281.54 g/mol
Exact Mass279.96
IUPAC Name5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane
SMILESCC.NC(=O)c1[nH]c(=O)c(Br)cc1Cl
InChIInChI=1S/C6H4BrClN2O2.C2H6/c7-2-1-3(8)4(5(9)11)10-6(2)12;1-2/h1H,(H2,9,11)(H,10,12);1-2H3
InChIKeyNAMMUEJLMFBZSG-UHFFFAOYSA-N
XLogP1.92
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.54
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane?
The IUPAC name of 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane (CID 144985918) is 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane.
What is the SMILES notation for 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane?
The canonical SMILES for 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane is CC.NC(=O)c1[nH]c(=O)c(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane?
The InChIKey is NAMMUEJLMFBZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClN2O2.C2H6/c7-2-1-3(8)4(5(9)11)10-6(2)12;1-2/h1H,(H2,9,11)(H,10,12);1-2H3.
What are the key properties of 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane?
5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane has a molecular weight of 281.54 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-6-oxo-1H-pyridine-2-carboxamide;ethane is sourced from PubChem (CID 144985918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).