8-bromoquinoline-2-carboxamide

C10H7BrN2O — CID 610197

IUPAC8-bromoquinoline-2-carboxamide
SMILESNC(=O)c1ccc2cccc(Br)c2n1
InChIInChI=1S/C10H7BrN2O/c11-7-3-1-2-6-4-5-8(10(12)14)13-9(6)7/h1-5H,(H2,12,14)
InChIKeyDTAZQXAUULGIGQ-UHFFFAOYSA-N
MW251.08 g/mol
LogP2.10
Rot. Bonds1

About 8-bromoquinoline-2-carboxamide

8-bromoquinoline-2-carboxamide (PubChem CID 610197) has the molecular formula C10H7BrN2O and a molecular weight of 251.08 g/mol. Its IUPAC name is 8-bromoquinoline-2-carboxamide.

Molecular Properties

Compound Name8-bromoquinoline-2-carboxamide
PubChem CID610197
Molecular FormulaC10H7BrN2O
Molecular Weight251.08 g/mol
Exact Mass249.97
IUPAC Name8-bromoquinoline-2-carboxamide
SMILESNC(=O)c1ccc2cccc(Br)c2n1
InChIInChI=1S/C10H7BrN2O/c11-7-3-1-2-6-4-5-8(10(12)14)13-9(6)7/h1-5H,(H2,12,14)
InChIKeyDTAZQXAUULGIGQ-UHFFFAOYSA-N
XLogP2.10
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.08
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-bromoquinoline-2-carboximidamide;hydrochloride
CID 82249989
5-bromoacridine-4-carboxamide
CID 174361134
2-[4-(8-bromoquinolin-2-yl)piperazin-1-yl]acetamide
CID 71917685
quinoline-2-carboxamide;hydrobromide
CID 141009871
1-(8-bromoquinolin-2-yl)-N-(2,6-dimethylphenyl)ethanimine
CID 147373459
2-carboxyquinolin-8-olate
CID 54696394
tris(2-carboxyquinolin-8-olate);terbium(3+)
CID 157443748
calcium bis(2-carboxyquinolin-8-olate)
CID 68819194
copper bis(2-carboxyquinolin-8-olate)
CID 54720975
bis(2-carboxyquinolin-8-olate);europium(2+)
CID 87928997
8-bromo-2-diphenylphosphorylquinoline
CID 155932211
2-chloroquinoline-8-carboxamide
CID 118665273

Frequently Asked Questions

What is the IUPAC name of 8-bromoquinoline-2-carboxamide?
The IUPAC name of 8-bromoquinoline-2-carboxamide (CID 610197) is 8-bromoquinoline-2-carboxamide.
What is the SMILES notation for 8-bromoquinoline-2-carboxamide?
The canonical SMILES for 8-bromoquinoline-2-carboxamide is NC(=O)c1ccc2cccc(Br)c2n1.
What is the InChIKey of 8-bromoquinoline-2-carboxamide?
The InChIKey is DTAZQXAUULGIGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN2O/c11-7-3-1-2-6-4-5-8(10(12)14)13-9(6)7/h1-5H,(H2,12,14).
What are the key properties of 8-bromoquinoline-2-carboxamide?
8-bromoquinoline-2-carboxamide has a molecular weight of 251.08 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromoquinoline-2-carboxamide is sourced from PubChem (CID 610197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).