N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide

C14H13BrN2O2 — CID 110863112

IUPACN-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2ccc(Br)c(C)c2)ccn1
InChIInChI=1S/C14H13BrN2O2/c1-9-7-11(3-4-12(9)15)17-14(18)10-5-6-16-13(8-10)19-2/h3-8H,1-2H3,(H,17,18)
InChIKeyOUZONGZBUKDQSY-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.41
Rot. Bonds3

About N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide

N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide (PubChem CID 110863112) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide
PubChem CID110863112
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC NameN-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2ccc(Br)c(C)c2)ccn1
InChIInChI=1S/C14H13BrN2O2/c1-9-7-11(3-4-12(9)15)17-14(18)10-5-6-16-13(8-10)19-2/h3-8H,1-2H3,(H,17,18)
InChIKeyOUZONGZBUKDQSY-UHFFFAOYSA-N
XLogP3.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
CID 3493450
N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
CID 710659
4-bromo-N-(3,4-dimethylphenyl)-3-methylbenzamide
CID 113396743
N-(4-chloro-2-methylphenyl)-2-methoxypyridine-4-carboxamide
CID 110859208
2-methoxy-N-pyridin-3-ylpyridine-4-carboxamide
CID 84580431
2-bromo-N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide
CID 103755165
4-bromo-3-methyl-N-(4-methylphenyl)benzamide
CID 113396750
N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
CID 110857659
N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 82859455
N-(4-bromo-3-methylphenyl)-3-methoxy-4-(2-methylpropoxy)benzamide
CID 18226846
N-(4-bromo-3-methoxyphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 82860502
2-bromo-N-(3-methylphenyl)pyridine-4-carboxamide
CID 86695841

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide (CID 110863112) is N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide is COc1cc(C(=O)Nc2ccc(Br)c(C)c2)ccn1.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide?
The InChIKey is OUZONGZBUKDQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c1-9-7-11(3-4-12(9)15)17-14(18)10-5-6-16-13(8-10)19-2/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide?
N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide has a molecular weight of 321.17 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide is sourced from PubChem (CID 110863112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).