3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide

C13H10Br2N2O2 — CID 107517604

IUPAC3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(Br)cc1NC(=O)c1ncccc1Br
InChIInChI=1S/C13H10Br2N2O2/c1-19-11-5-4-8(14)7-10(11)17-13(18)12-9(15)3-2-6-16-12/h2-7H,1H3,(H,17,18)
InChIKeyWQLUHPZIFIPGCV-UHFFFAOYSA-N
MW386.04 g/mol
LogP3.87
Rot. Bonds3

About 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide

3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 107517604) has the molecular formula C13H10Br2N2O2 and a molecular weight of 386.04 g/mol. Its IUPAC name is 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide
PubChem CID107517604
Molecular FormulaC13H10Br2N2O2
Molecular Weight386.04 g/mol
Exact Mass383.91
IUPAC Name3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(Br)cc1NC(=O)c1ncccc1Br
InChIInChI=1S/C13H10Br2N2O2/c1-19-11-5-4-8(14)7-10(11)17-13(18)12-9(15)3-2-6-16-12/h2-7H,1H3,(H,17,18)
InChIKeyWQLUHPZIFIPGCV-UHFFFAOYSA-N
XLogP3.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.04
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-(4-chloro-2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 107517707
4-bromo-2-[(3-bromopyridine-2-carbonyl)amino]benzoic acid
CID 107517024
3-bromo-N-(2-hydroxy-5-methoxyphenyl)pyridine-2-carboxamide
CID 100626148
2-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-4-carboxamide
CID 103754801
N-(2,5-dibromophenyl)-3-hydroxypyridine-2-carboxamide
CID 54955142
3-bromo-N-(3-bromo-5-chloro-2-methoxyphenyl)pyridine-2-carboxamide
CID 107518279
N-(2-amino-5-methoxyphenyl)-3-bromopyridine-2-carboxamide
CID 107519991
3-bromo-N-(4-methoxy-3-nitrophenyl)pyridine-2-carboxamide
CID 107519279
3-hydroxy-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 54860878
4-bromo-N-(5-bromo-2-methoxyphenyl)-2-methoxybenzamide
CID 78987917
2-amino-N-(5-bromo-2-methoxyphenyl)pyridine-4-carboxamide
CID 62187195
N-(5-bromo-2-methoxyphenyl)-6-methylpyridine-2-carboxamide
CID 47317681

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide (CID 107517604) is 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide is COc1ccc(Br)cc1NC(=O)c1ncccc1Br.
What is the InChIKey of 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is WQLUHPZIFIPGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Br2N2O2/c1-19-11-5-4-8(14)7-10(11)17-13(18)12-9(15)3-2-6-16-12/h2-7H,1H3,(H,17,18).
What are the key properties of 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide?
3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 386.04 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(5-bromo-2-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 107517604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).