N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide

C15H15BrN2O3 — CID 17274555

IUPACN-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Br)c(C)n2)c(OC)c1
InChIInChI=1S/C15H15BrN2O3/c1-9-12(16)6-7-14(17-9)18-15(19)11-5-4-10(20-2)8-13(11)21-3/h4-8H,1-3H3,(H,17,18,19)
InChIKeyCEAXHDNOBWDBPU-UHFFFAOYSA-N
MW351.20 g/mol
LogP3.42
Rot. Bonds4

About N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide

N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide (PubChem CID 17274555) has the molecular formula C15H15BrN2O3 and a molecular weight of 351.20 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide
PubChem CID17274555
Molecular FormulaC15H15BrN2O3
Molecular Weight351.20 g/mol
Exact Mass350.03
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Br)c(C)n2)c(OC)c1
InChIInChI=1S/C15H15BrN2O3/c1-9-12(16)6-7-14(17-9)18-15(19)11-5-4-10(20-2)8-13(11)21-3/h4-8H,1-3H3,(H,17,18,19)
InChIKeyCEAXHDNOBWDBPU-UHFFFAOYSA-N
XLogP3.42
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.20
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-6-methyl-2-pyridinyl)-2-hydroxy-4-methoxybenzamide
CID 79048960
2,4-dimethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 670331
N-(5-bromo-6-methyl-2-pyridinyl)-3-chloro-4-methoxybenzamide
CID 1396763
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide
CID 903456
2,4-dimethoxy-N-(5-methyl-1H-1,2,4-triazol-3-yl)benzamide
CID 78928069
N-(5-bromo-3-methyl-2-pyridinyl)-2,4-dimethoxybenzamide
CID 81487581
N-(5-bromo-6-methyl-2-pyridinyl)-2,3-dihydroxybenzamide
CID 114343707
N-(5-bromo-6-methyl-2-pyridinyl)-2,3,5,6-tetrafluoro-4-methoxybenzamide
CID 25239366
N-(5-bromo-4-methyl-2-pyridinyl)-2,5-dimethoxybenzamide
CID 79736443
N-(5-bromo-6-methyl-2-pyridinyl)-2,6-dichloropyridine-3-carboxamide
CID 103715596
N-(5-bromo-6-methyl-2-pyridinyl)-4-ethoxybenzamide
CID 925722
N-(5-bromo-6-methyl-2-pyridinyl)-2,4,6-trimethylbenzamide
CID 79048667

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide (CID 17274555) is N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccc(Br)c(C)n2)c(OC)c1.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide?
The InChIKey is CEAXHDNOBWDBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3/c1-9-12(16)6-7-14(17-9)18-15(19)11-5-4-10(20-2)8-13(11)21-3/h4-8H,1-3H3,(H,17,18,19).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide?
N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide has a molecular weight of 351.20 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide is sourced from PubChem (CID 17274555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).