5-bromo-2-chloro-N-methoxypyridine-3-carboxamide

C7H6BrClN2O2 — CID 103636119

IUPAC5-bromo-2-chloro-N-methoxypyridine-3-carboxamide
SMILESCONC(=O)c1cc(Br)cnc1Cl
InChIInChI=1S/C7H6BrClN2O2/c1-13-11-7(12)5-2-4(8)3-10-6(5)9/h2-3H,1H3,(H,11,12)
InChIKeyUEULAHDRZSLMJW-UHFFFAOYSA-N
MW265.49 g/mol
LogP1.79
Rot. Bonds2

About 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide

5-bromo-2-chloro-N-methoxypyridine-3-carboxamide (PubChem CID 103636119) has the molecular formula C7H6BrClN2O2 and a molecular weight of 265.49 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-methoxypyridine-3-carboxamide
PubChem CID103636119
Molecular FormulaC7H6BrClN2O2
Molecular Weight265.49 g/mol
Exact Mass263.93
IUPAC Name5-bromo-2-chloro-N-methoxypyridine-3-carboxamide
SMILESCONC(=O)c1cc(Br)cnc1Cl
InChIInChI=1S/C7H6BrClN2O2/c1-13-11-7(12)5-2-4(8)3-10-6(5)9/h2-3H,1H3,(H,11,12)
InChIKeyUEULAHDRZSLMJW-UHFFFAOYSA-N
XLogP1.79
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.49
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-amino-2-methyl-1-oxopropan-2-yl)-5-bromo-2-chloropyridine-3-carboxamide
CID 62000658
5-bromo-2-chloro-N-[2-(2-methoxyethoxy)ethyl]pyridine-3-carboxamide
CID 62001049
5-bromo-2-chloropyridine-3-carboxamide
CID 12629794
N-(4-amino-4-oxobutan-2-yl)-5-bromo-2-chloropyridine-3-carboxamide
CID 115664789
5-bromo-2-chloro-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 62001368
N-(4-amino-4-oxobutyl)-5-bromo-2-chloropyridine-3-carboxamide
CID 62000055
5-bromo-2-chloro-N-(4-chloro-3-methoxyphenyl)pyridine-3-carboxamide
CID 107300867
5-bromo-2-chloro-N-(4-fluoro-3-methoxyphenyl)pyridine-3-carboxamide
CID 114839248
5-bromo-2-chloro-N-phenylpyridine-3-carboxamide
CID 59781136
5-bromo-2-chloro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 62000214
5-bromo-2-chloro-N-(2-methoxyethyl)-N-methylpyridine-3-carboxamide
CID 62001227
(2S,3R)-2-[(5-bromo-2-chloropyridine-3-carbonyl)amino]-3-hydroxybutanoic acid
CID 114037234

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide (CID 103636119) is 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide is CONC(=O)c1cc(Br)cnc1Cl.
What is the InChIKey of 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide?
The InChIKey is UEULAHDRZSLMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrClN2O2/c1-13-11-7(12)5-2-4(8)3-10-6(5)9/h2-3H,1H3,(H,11,12).
What are the key properties of 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide?
5-bromo-2-chloro-N-methoxypyridine-3-carboxamide has a molecular weight of 265.49 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-N-methoxypyridine-3-carboxamide is sourced from PubChem (CID 103636119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).