N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide

C13H11Br2N3O — CID 55152866

IUPACN-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide
SMILESCc1cc(Br)cc(N)c1NC(=O)c1ccc(Br)cn1
InChIInChI=1S/C13H11Br2N3O/c1-7-4-9(15)5-10(16)12(7)18-13(19)11-3-2-8(14)6-17-11/h2-6H,16H2,1H3,(H,18,19)
InChIKeyHGJCLOCXPBTKQF-UHFFFAOYSA-N
MW385.06 g/mol
LogP3.75
Rot. Bonds2

About N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide

N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide (PubChem CID 55152866) has the molecular formula C13H11Br2N3O and a molecular weight of 385.06 g/mol. Its IUPAC name is N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide
PubChem CID55152866
Molecular FormulaC13H11Br2N3O
Molecular Weight385.06 g/mol
Exact Mass382.93
IUPAC NameN-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide
SMILESCc1cc(Br)cc(N)c1NC(=O)c1ccc(Br)cn1
InChIInChI=1S/C13H11Br2N3O/c1-7-4-9(15)5-10(16)12(7)18-13(19)11-3-2-8(14)6-17-11/h2-6H,16H2,1H3,(H,18,19)
InChIKeyHGJCLOCXPBTKQF-UHFFFAOYSA-N
XLogP3.75
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.06
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-(4-bromo-2-methoxy-6-methylphenyl)pyridine-2-carboxamide
CID 62954905
N-(2-amino-4-bromo-6-methylphenyl)-6-methylpyridine-2-carboxamide
CID 43550019
N-(3-amino-2,6-dimethylphenyl)-5-bromopyridine-2-carboxamide
CID 62958756
N-(3-amino-4-methylphenyl)-5-bromopyridine-2-carboxamide
CID 62958589
N-(2-amino-4-bromophenyl)-5-bromopyridine-2-carboxamide
CID 62958937
N-(2-amino-4-bromo-6-methylphenyl)-2-methylpyridine-4-carboxamide
CID 106752400
N-(2-amino-4-bromo-6-methylphenyl)-5-bromofuran-2-carboxamide
CID 43550021
5-bromo-N-(2-chloro-6-methylphenyl)pyridine-2-carboxamide
CID 66255147
N-(2-amino-4-bromo-6-methylphenyl)-2,4-dichlorobenzamide
CID 43549936
N-(2-amino-4-bromo-6-methylphenyl)-4-chloro-2-fluorobenzamide
CID 43549986
N-(2-amino-4-bromo-6-methylphenyl)-5-bromo-4-methylthiophene-2-carboxamide
CID 79976343
N-(2-amino-4-bromo-6-methylphenyl)-2-(4-bromophenyl)acetamide
CID 43550029

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide?
The IUPAC name of N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide (CID 55152866) is N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide?
The canonical SMILES for N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide is Cc1cc(Br)cc(N)c1NC(=O)c1ccc(Br)cn1.
What is the InChIKey of N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide?
The InChIKey is HGJCLOCXPBTKQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Br2N3O/c1-7-4-9(15)5-10(16)12(7)18-13(19)11-3-2-8(14)6-17-11/h2-6H,16H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide?
N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide has a molecular weight of 385.06 g/mol, XLogP of 3.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-bromo-6-methylphenyl)-5-bromopyridine-2-carboxamide is sourced from PubChem (CID 55152866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).