2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide

C12H7BrCl3N3O — CID 62155953

IUPAC2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cc(Cl)n1
InChIInChI=1S/C12H7BrCl3N3O/c13-6-3-7(14)11(8(15)4-6)19-12(20)5-1-9(16)18-10(17)2-5/h1-4H,(H2,17,18)(H,19,20)
InChIKeyQEOBEYCOOUKTPE-UHFFFAOYSA-N
MW395.47 g/mol
LogP4.64
Rot. Bonds2

About 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide

2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide (PubChem CID 62155953) has the molecular formula C12H7BrCl3N3O and a molecular weight of 395.47 g/mol. Its IUPAC name is 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide
PubChem CID62155953
Molecular FormulaC12H7BrCl3N3O
Molecular Weight395.47 g/mol
Exact Mass392.88
IUPAC Name2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cc(Cl)n1
InChIInChI=1S/C12H7BrCl3N3O/c13-6-3-7(14)11(8(15)4-6)19-12(20)5-1-9(16)18-10(17)2-5/h1-4H,(H2,17,18)(H,19,20)
InChIKeyQEOBEYCOOUKTPE-UHFFFAOYSA-N
XLogP4.64
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,6-dichloro-N-(2,4,6-trichlorophenyl)pyridine-4-carboxamide
CID 43343719
2-amino-N-(5-bromo-2-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62159768
2-amino-N-(2-bromo-5-chlorophenyl)-6-chloropyridine-4-carboxamide
CID 81275531
2-amino-6-chloro-N-(2,6-diethylphenyl)pyridine-4-carboxamide
CID 62153038
2-amino-N-(5-bromo-1,3-thiazol-2-yl)-6-chloropyridine-4-carboxamide
CID 62160793
2-amino-N-(3-bromo-4-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62871680
2-amino-6-chloro-N-(1,2-thiazol-4-yl)pyridine-4-carboxamide
CID 154842220
2-amino-N-(5-bromo-2-methoxyphenyl)-6-chloropyridine-4-carboxamide
CID 62187028
2-amino-6-chloro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 62156439
2-amino-N-(4-bromo-2,6-dichlorophenyl)-1,3-thiazole-4-carboxamide
CID 55116387
2-amino-6-chloro-N-(2-iodophenyl)pyridine-4-carboxamide
CID 62154227
N-(4-bromo-2,6-dichlorophenyl)-4-fluorobenzamide
CID 60651944

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide (CID 62155953) is 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide is Nc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cc(Cl)n1.
What is the InChIKey of 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide?
The InChIKey is QEOBEYCOOUKTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrCl3N3O/c13-6-3-7(14)11(8(15)4-6)19-12(20)5-1-9(16)18-10(17)2-5/h1-4H,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide?
2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide has a molecular weight of 395.47 g/mol, XLogP of 4.64, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-bromo-2,6-dichlorophenyl)-6-chloropyridine-4-carboxamide is sourced from PubChem (CID 62155953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).