N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide

C12H9BrN4OS — CID 110455326

IUPACN-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide
SMILESCc1c(Br)ccc2nc(NC(=O)c3cccs3)nn12
InChIInChI=1S/C12H9BrN4OS/c1-7-8(13)4-5-10-14-12(16-17(7)10)15-11(18)9-3-2-6-19-9/h2-6H,1H3,(H,15,16,18)
InChIKeyNNYSKBVVZPADIF-UHFFFAOYSA-N
MW337.20 g/mol
LogP3.11
Rot. Bonds2

About N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide

N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide (PubChem CID 110455326) has the molecular formula C12H9BrN4OS and a molecular weight of 337.20 g/mol. Its IUPAC name is N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide
PubChem CID110455326
Molecular FormulaC12H9BrN4OS
Molecular Weight337.20 g/mol
Exact Mass335.97
IUPAC NameN-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide
SMILESCc1c(Br)ccc2nc(NC(=O)c3cccs3)nn12
InChIInChI=1S/C12H9BrN4OS/c1-7-8(13)4-5-10-14-12(16-17(7)10)15-11(18)9-3-2-6-19-9/h2-6H,1H3,(H,15,16,18)
InChIKeyNNYSKBVVZPADIF-UHFFFAOYSA-N
XLogP3.11
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.20
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromo-3-methylimidazo[1,2-a]pyridin-6-yl)thiophene-2-carboxamide
CID 115268770
N-(4-bromo-3-methylphenyl)thiophene-2-carboxamide
CID 743467
N-[6-(2,4-dichlorophenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]thiophene-2-carboxamide
CID 108728681
N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
CID 17013680
N-(2-ethenyltetrazol-5-yl)thiophene-2-carboxamide
CID 17162708
N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-4-oxo-4-thiophen-2-ylbutanamide
CID 108740560
N'-(3-bromo-4-methylbenzoyl)thiophene-2-carbohydrazide
CID 920970
[2-oxo-2-(thiophene-2-carbonylamino)ethyl] 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate
CID 8782908
N-(2,3-dimethylquinoxalin-6-yl)thiophene-2-carboxamide
CID 110723801
N-(1-methyl-2-oxopyrimidin-4-yl)thiophene-2-carboxamide
CID 102304766
N-[4,6-bis(4-chlorophenyl)pyrimidin-2-yl]thiophene-2-carboxamide
CID 20896251
N-(3,5-dimethyl-1H-pyrazol-4-yl)thiophene-2-carboxamide
CID 43399092

Frequently Asked Questions

What is the IUPAC name of N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide?
The IUPAC name of N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide (CID 110455326) is N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide is Cc1c(Br)ccc2nc(NC(=O)c3cccs3)nn12.
What is the InChIKey of N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide?
The InChIKey is NNYSKBVVZPADIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrN4OS/c1-7-8(13)4-5-10-14-12(16-17(7)10)15-11(18)9-3-2-6-19-9/h2-6H,1H3,(H,15,16,18).
What are the key properties of N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide?
N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide has a molecular weight of 337.20 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-bromo-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 110455326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).