N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide

C10H8N6OS — CID 171351546

IUPACN-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
SMILESCC(=O)Nc1nc2nccc(-c3nccs3)n2n1
InChIInChI=1S/C10H8N6OS/c1-6(17)13-9-14-10-12-3-2-7(16(10)15-9)8-11-4-5-18-8/h2-5H,1H3,(H,13,15,17)
InChIKeyWWBIXILNMDHASR-UHFFFAOYSA-N
MW260.28 g/mol
LogP1.21
Rot. Bonds2

About N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide

N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide (PubChem CID 171351546) has the molecular formula C10H8N6OS and a molecular weight of 260.28 g/mol. Its IUPAC name is N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide.

Molecular Properties

Compound NameN-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
PubChem CID171351546
Molecular FormulaC10H8N6OS
Molecular Weight260.28 g/mol
Exact Mass260.05
IUPAC NameN-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
SMILESCC(=O)Nc1nc2nccc(-c3nccs3)n2n1
InChIInChI=1S/C10H8N6OS/c1-6(17)13-9-14-10-12-3-2-7(16(10)15-9)8-11-4-5-18-8/h2-5H,1H3,(H,13,15,17)
InChIKeyWWBIXILNMDHASR-UHFFFAOYSA-N
XLogP1.21
TPSA85.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.28
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)acetamide
CID 24768407
7-methyl-N-(4-methyl-1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2093872
5,7-dimethyl-N-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2468986
7-methyl-N-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2531445
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2397006
7-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2505294
N-(5-butyl-1,3,4-thiadiazol-2-yl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2564268
N-(2,5-dimethylpyrazol-3-yl)-2-[3-methyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 75369831
3-(3-Methyl-1H-pyrazol-1-YL)-N-(1,3-thiazol-2-YL)propanamide
CID 45106807
7-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl][1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide
CID 121509279
5-methyl-N-[3-(1,3-thiazol-2-yl)propyl]-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 53590024
N-[(1S)-1-(1,3-thiazol-5-yl)ethyl]-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 99802721

Frequently Asked Questions

What is the IUPAC name of N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide?
The IUPAC name of N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide (CID 171351546) is N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide.
What is the SMILES notation for N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide?
The canonical SMILES for N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide is CC(=O)Nc1nc2nccc(-c3nccs3)n2n1.
What is the InChIKey of N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide?
The InChIKey is WWBIXILNMDHASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6OS/c1-6(17)13-9-14-10-12-3-2-7(16(10)15-9)8-11-4-5-18-8/h2-5H,1H3,(H,13,15,17).
What are the key properties of N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide?
N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide has a molecular weight of 260.28 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide is sourced from PubChem (CID 171351546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).