8-bromoquinoline-2-carboximidamide;hydrochloride

C10H9BrClN3 — CID 82249989

IUPAC8-bromoquinoline-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc2cccc(Br)c2n1
InChIInChI=1S/C10H8BrN3.ClH/c11-7-3-1-2-6-4-5-8(10(12)13)14-9(6)7;/h1-5H,(H3,12,13);1H
InChIKeyKMVWTMOOUKBDGA-UHFFFAOYSA-N
MW286.56 g/mol
LogP2.70
Rot. Bonds1

About 8-bromoquinoline-2-carboximidamide;hydrochloride

8-bromoquinoline-2-carboximidamide;hydrochloride (PubChem CID 82249989) has the molecular formula C10H9BrClN3 and a molecular weight of 286.56 g/mol. Its IUPAC name is 8-bromoquinoline-2-carboximidamide;hydrochloride.

Molecular Properties

Compound Name8-bromoquinoline-2-carboximidamide;hydrochloride
PubChem CID82249989
Molecular FormulaC10H9BrClN3
Molecular Weight286.56 g/mol
Exact Mass284.97
IUPAC Name8-bromoquinoline-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc2cccc(Br)c2n1
InChIInChI=1S/C10H8BrN3.ClH/c11-7-3-1-2-6-4-5-8(10(12)13)14-9(6)7;/h1-5H,(H3,12,13);1H
InChIKeyKMVWTMOOUKBDGA-UHFFFAOYSA-N
XLogP2.70
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.56
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

8-bromoquinoline-2-carboxamide
CID 610197
quinoline-2-carboximidamide;dihydrochloride
CID 42614305
pyridine-2,6-dicarboximidamide
CID 23373306
1-(8-bromoquinolin-2-yl)-N-(2,6-dimethylphenyl)ethanimine
CID 147373459
6-pyridin-4-ylpyridine-2-carboximidamide;hydrochloride
CID 46839680
2-amino-6-bromobenzenecarboximidamide
CID 114883758
6-ethylpyridine-2-carboximidamide
CID 14253206
6,7-dibromonaphthalene-2-carboximidamide;hydrochloride
CID 121232084
isoquinoline-3-carboximidamide
CID 5069411
2-(2-bromo-6-nitrophenoxy)pyrimidine-4-carboximidamide
CID 107551192
ethane;6-methyl-1,5-naphthyridine-2-carboximidamide
CID 172623231
4-bromo-6-methylpyridine-2-carboximidamide;hydrochloride
CID 133054142

Frequently Asked Questions

What is the IUPAC name of 8-bromoquinoline-2-carboximidamide;hydrochloride?
The IUPAC name of 8-bromoquinoline-2-carboximidamide;hydrochloride (CID 82249989) is 8-bromoquinoline-2-carboximidamide;hydrochloride.
What is the SMILES notation for 8-bromoquinoline-2-carboximidamide;hydrochloride?
The canonical SMILES for 8-bromoquinoline-2-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1ccc2cccc(Br)c2n1.
What is the InChIKey of 8-bromoquinoline-2-carboximidamide;hydrochloride?
The InChIKey is KMVWTMOOUKBDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3.ClH/c11-7-3-1-2-6-4-5-8(10(12)13)14-9(6)7;/h1-5H,(H3,12,13);1H.
What are the key properties of 8-bromoquinoline-2-carboximidamide;hydrochloride?
8-bromoquinoline-2-carboximidamide;hydrochloride has a molecular weight of 286.56 g/mol, XLogP of 2.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromoquinoline-2-carboximidamide;hydrochloride is sourced from PubChem (CID 82249989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).