N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide

C13H10BrCl2N3O — CID 62909137

IUPACN-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2cc(Br)ccc2Cl)cc1Cl
InChIInChI=1S/C13H10BrCl2N3O/c1-17-12-10(16)4-7(6-18-12)13(20)19-11-5-8(14)2-3-9(11)15/h2-6H,1H3,(H,17,18)(H,19,20)
InChIKeyBHUZAVLAAGTOOR-UHFFFAOYSA-N
MW375.05 g/mol
LogP4.44
Rot. Bonds3

About N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide

N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide (PubChem CID 62909137) has the molecular formula C13H10BrCl2N3O and a molecular weight of 375.05 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
PubChem CID62909137
Molecular FormulaC13H10BrCl2N3O
Molecular Weight375.05 g/mol
Exact Mass372.94
IUPAC NameN-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2cc(Br)ccc2Cl)cc1Cl
InChIInChI=1S/C13H10BrCl2N3O/c1-17-12-10(16)4-7(6-18-12)13(20)19-11-5-8(14)2-3-9(11)15/h2-6H,1H3,(H,17,18)(H,19,20)
InChIKeyBHUZAVLAAGTOOR-UHFFFAOYSA-N
XLogP4.44
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.05
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-chlorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62908966
N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 62185392
5-chloro-N-(2-chloro-4-iodophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 107606074
5-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62172945
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
N-(5-bromo-2-fluorophenyl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
CID 62168364
5-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62165739
N-(5-bromo-4-fluoro-2-methylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 107593909
5-chloro-N-(3-fluoro-4-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 107595440
5-chloro-N-(4-chloro-3-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62176655
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172629

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide (CID 62909137) is N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)Nc2cc(Br)ccc2Cl)cc1Cl.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is BHUZAVLAAGTOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrCl2N3O/c1-17-12-10(16)4-7(6-18-12)13(20)19-11-5-8(14)2-3-9(11)15/h2-6H,1H3,(H,17,18)(H,19,20).
What are the key properties of N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide?
N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 375.05 g/mol, XLogP of 4.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62909137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).