N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide

C10H9BrN4OS — CID 55052576

IUPACN-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2ncc(Br)s2)n1
InChIInChI=1S/C10H9BrN4OS/c1-12-8-4-2-3-6(14-8)9(16)15-10-13-5-7(11)17-10/h2-5H,1H3,(H,12,14)(H,13,15,16)
InChIKeyOAEGCURSTPQIOW-UHFFFAOYSA-N
MW313.18 g/mol
LogP2.59
Rot. Bonds3

About N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide

N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide (PubChem CID 55052576) has the molecular formula C10H9BrN4OS and a molecular weight of 313.18 g/mol. Its IUPAC name is N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide
PubChem CID55052576
Molecular FormulaC10H9BrN4OS
Molecular Weight313.18 g/mol
Exact Mass311.97
IUPAC NameN-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2ncc(Br)s2)n1
InChIInChI=1S/C10H9BrN4OS/c1-12-8-4-2-3-6(14-8)9(16)15-10-13-5-7(11)17-10/h2-5H,1H3,(H,12,14)(H,13,15,16)
InChIKeyOAEGCURSTPQIOW-UHFFFAOYSA-N
XLogP2.59
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.18
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 62238936
N-(5-bromo-4-methyl-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 79730155
N-(5-bromo-1,3-thiazol-2-yl)-2-(methylamino)pyridine-4-carboxamide
CID 62181432
N-(5-bromo-6-methyl-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 79048918
N-(5-bromo-1,3-thiazol-2-yl)-5-methylpyrazine-2-carboxamide
CID 103602102
N-(5-bromo-1,3-thiazol-2-yl)pyrimidine-4-carboxamide
CID 130821730
N-(3-bromo-2-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107630995
N-(5-bromo-1,3-thiazol-2-yl)furan-2-carboxamide
CID 60655632
N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62238561
N-(5-bromo-1,3-thiazol-2-yl)-3-hydroxybenzamide
CID 60654759
N-(4-bromo-3-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62239926
N-(2-chlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62241147

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide (CID 55052576) is N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide is CNc1cccc(C(=O)Nc2ncc(Br)s2)n1.
What is the InChIKey of N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is OAEGCURSTPQIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN4OS/c1-12-8-4-2-3-6(14-8)9(16)15-10-13-5-7(11)17-10/h2-5H,1H3,(H,12,14)(H,13,15,16).
What are the key properties of N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide?
N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 313.18 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 55052576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).