N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide

C15H15BrClN3O — CID 62185392

IUPACN-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2c(C)cc(Br)cc2C)cc1Cl
InChIInChI=1S/C15H15BrClN3O/c1-8-4-11(16)5-9(2)13(8)20-15(21)10-6-12(17)14(18-3)19-7-10/h4-7H,1-3H3,(H,18,19)(H,20,21)
InChIKeyXRXQHEWTGAUJAW-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.41
Rot. Bonds3

About N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide

N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide (PubChem CID 62185392) has the molecular formula C15H15BrClN3O and a molecular weight of 368.66 g/mol. Its IUPAC name is N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
PubChem CID62185392
Molecular FormulaC15H15BrClN3O
Molecular Weight368.66 g/mol
Exact Mass367.01
IUPAC NameN-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2c(C)cc(Br)cc2C)cc1Cl
InChIInChI=1S/C15H15BrClN3O/c1-8-4-11(16)5-9(2)13(8)20-15(21)10-6-12(17)14(18-3)19-7-10/h4-7H,1-3H3,(H,18,19)(H,20,21)
InChIKeyXRXQHEWTGAUJAW-UHFFFAOYSA-N
XLogP4.41
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.66
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 62909137
N-(5-bromo-4-fluoro-2-methylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 107593909
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172629
5-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62172945
5-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62165739
5-chloro-N-(2-chloro-4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62166998
5-chloro-N-(4-iodophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62166490
5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62167429
5-chloro-N-(4-methoxy-2-methylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62872107
5-chloro-N-(2-chloro-4-iodophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 107606074
3-bromo-N-(4-bromo-2,6-dimethylphenyl)-4-chlorobenzamide
CID 107999136
5-chloro-6-(methylamino)-N-pyridin-3-ylpyridine-3-carboxamide
CID 62172922

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide (CID 62185392) is N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)Nc2c(C)cc(Br)cc2C)cc1Cl.
What is the InChIKey of N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is XRXQHEWTGAUJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClN3O/c1-8-4-11(16)5-9(2)13(8)20-15(21)10-6-12(17)14(18-3)19-7-10/h4-7H,1-3H3,(H,18,19)(H,20,21).
What are the key properties of N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 368.66 g/mol, XLogP of 4.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62185392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).