3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide

C14H12Br2N2O — CID 113460607

IUPAC3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide
SMILESCc1cc(Br)cc(C(=O)Nc2ccc(Br)c(C)n2)c1
InChIInChI=1S/C14H12Br2N2O/c1-8-5-10(7-11(15)6-8)14(19)18-13-4-3-12(16)9(2)17-13/h3-7H,1-2H3,(H,17,18,19)
InChIKeyLSIVSYWMSCYHAP-UHFFFAOYSA-N
MW384.07 g/mol
LogP4.48
Rot. Bonds2

About 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide

3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide (PubChem CID 113460607) has the molecular formula C14H12Br2N2O and a molecular weight of 384.07 g/mol. Its IUPAC name is 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide.

Molecular Properties

Compound Name3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide
PubChem CID113460607
Molecular FormulaC14H12Br2N2O
Molecular Weight384.07 g/mol
Exact Mass381.93
IUPAC Name3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide
SMILESCc1cc(Br)cc(C(=O)Nc2ccc(Br)c(C)n2)c1
InChIInChI=1S/C14H12Br2N2O/c1-8-5-10(7-11(15)6-8)14(19)18-13-4-3-12(16)9(2)17-13/h3-7H,1-2H3,(H,17,18,19)
InChIKeyLSIVSYWMSCYHAP-UHFFFAOYSA-N
XLogP4.48
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.07
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-(5-bromo-6-methyl-2-pyridinyl)benzamide
CID 4509258
N-(5-bromo-6-methyl-2-pyridinyl)-2,4,6-trimethylbenzamide
CID 79048667
N-(5-bromo-6-methyl-2-pyridinyl)-3,4-dichlorobenzamide
CID 4509260
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 79048356
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
CID 79049112
N-(5-bromo-6-methyl-2-pyridinyl)-2-chloro-6-(methylamino)pyridine-4-carboxamide
CID 79048306
3-bromo-N-(2-bromo-5-methylphenyl)-5-methylbenzamide
CID 104851666
N-(5-bromo-6-methyl-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 79048580
N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide
CID 79048508
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
CID 79049145
N-(5-bromo-6-methyl-2-pyridinyl)-4-ethoxybenzamide
CID 925722
N-(5-bromo-6-methyl-2-pyridinyl)-2-chloropyridine-4-carboxamide
CID 71987347

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide?
The IUPAC name of 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide (CID 113460607) is 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide.
What is the SMILES notation for 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide?
The canonical SMILES for 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide is Cc1cc(Br)cc(C(=O)Nc2ccc(Br)c(C)n2)c1.
What is the InChIKey of 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide?
The InChIKey is LSIVSYWMSCYHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O/c1-8-5-10(7-11(15)6-8)14(19)18-13-4-3-12(16)9(2)17-13/h3-7H,1-2H3,(H,17,18,19).
What are the key properties of 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide?
3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide has a molecular weight of 384.07 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide is sourced from PubChem (CID 113460607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).