5-bromo-6-methylpyridine-3-carboximidamide

C7H8BrN3 — CID 83886236

IUPAC5-bromo-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cnc(C)c(Br)c1
InChIInChI=1S/C7H8BrN3/c1-4-6(8)2-5(3-11-4)7(9)10/h2-3H,1H3,(H3,9,10)
InChIKeySVFZKQQEBYZBSR-UHFFFAOYSA-N
MW214.07 g/mol
LogP1.44
Rot. Bonds1

About 5-bromo-6-methylpyridine-3-carboximidamide

5-bromo-6-methylpyridine-3-carboximidamide (PubChem CID 83886236) has the molecular formula C7H8BrN3 and a molecular weight of 214.07 g/mol. Its IUPAC name is 5-bromo-6-methylpyridine-3-carboximidamide.

Molecular Properties

Compound Name5-bromo-6-methylpyridine-3-carboximidamide
PubChem CID83886236
Molecular FormulaC7H8BrN3
Molecular Weight214.07 g/mol
Exact Mass212.99
IUPAC Name5-bromo-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cnc(C)c(Br)c1
InChIInChI=1S/C7H8BrN3/c1-4-6(8)2-5(3-11-4)7(9)10/h2-3H,1H3,(H3,9,10)
InChIKeySVFZKQQEBYZBSR-UHFFFAOYSA-N
XLogP1.44
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.07
LogP ≤ 51.44
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

3-bromo-4-(5-methylpyrimidin-2-yl)sulfanylbenzenecarboximidamide
CID 82799268
6-(4-bromo-3-methylphenoxy)pyridine-3-carboximidamide
CID 83141115
2-aminopyrimidine-5-carboximidamide
CID 45080078
2,3-dimethylimidazo[4,5-b]pyridine-6-carboximidamide
CID 83877151
3-bromo-4-(4-bromo-3,5-dimethylpyrazol-1-yl)benzenecarboximidamide
CID 82800276
3,6-dimethylpyrazine-2-carboximidamide;hydrochloride
CID 122129858
3-bromo-4-(3,5-dimethyl-1,2,4-triazol-1-yl)benzenecarboximidamide
CID 82799867
5-bromo-2,3-dihydro-1,4-benzodioxine-7-carboximidamide
CID 43143915
3-bromo-5-iodopyridine-2-carboximidamide
CID 133055702
5-iodopyridine-3-carboximidamide
CID 74892022
3-bromo-4-(4-methylphenoxy)benzenecarboximidamide
CID 82799325
6-(3-bromo-4-fluorophenoxy)pyridine-3-carboximidamide
CID 83235122

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methylpyridine-3-carboximidamide?
The IUPAC name of 5-bromo-6-methylpyridine-3-carboximidamide (CID 83886236) is 5-bromo-6-methylpyridine-3-carboximidamide.
What is the SMILES notation for 5-bromo-6-methylpyridine-3-carboximidamide?
The canonical SMILES for 5-bromo-6-methylpyridine-3-carboximidamide is [H]/N=C(\N)c1cnc(C)c(Br)c1.
What is the InChIKey of 5-bromo-6-methylpyridine-3-carboximidamide?
The InChIKey is SVFZKQQEBYZBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrN3/c1-4-6(8)2-5(3-11-4)7(9)10/h2-3H,1H3,(H3,9,10).
What are the key properties of 5-bromo-6-methylpyridine-3-carboximidamide?
5-bromo-6-methylpyridine-3-carboximidamide has a molecular weight of 214.07 g/mol, XLogP of 1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methylpyridine-3-carboximidamide is sourced from PubChem (CID 83886236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).