2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide

C12H10N6OS — CID 155536231

IUPAC2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Cn1cc(-c2ccncc2)nn1)Nc1nccs1
InChIInChI=1S/C12H10N6OS/c19-11(15-12-14-5-6-20-12)8-18-7-10(16-17-18)9-1-3-13-4-2-9/h1-7H,8H2,(H,14,15,19)
InChIKeyTZDKUSLJUFFSNB-UHFFFAOYSA-N
MW286.32 g/mol
LogP1.44
Rot. Bonds4

About 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide

2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 155536231) has the molecular formula C12H10N6OS and a molecular weight of 286.32 g/mol. Its IUPAC name is 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID155536231
Molecular FormulaC12H10N6OS
Molecular Weight286.32 g/mol
Exact Mass286.06
IUPAC Name2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Cn1cc(-c2ccncc2)nn1)Nc1nccs1
InChIInChI=1S/C12H10N6OS/c19-11(15-12-14-5-6-20-12)8-18-7-10(16-17-18)9-1-3-13-4-2-9/h1-7H,8H2,(H,14,15,19)
InChIKeyTZDKUSLJUFFSNB-UHFFFAOYSA-N
XLogP1.44
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.32
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(pyridin-4-ylmethyl)-N'-(1,3-thiazol-2-yl)ethanediamide
CID 564741
N-(pyridin-3-ylmethyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 1963831
2-(4-Methyl-5-pyridin-4-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(4-methyl-thiazol-2-yl)-acetamide
CID 645763
2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 1155032
2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
CID 7207400
N-[4'-methyl-2-(2-pyridinylamino)-4,5'-bi-1,3-thiazol-2'-yl]propanamide
CID 755435
2-{[4-ethyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
CID 6470620
2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)propanamide
CID 6472640
2-((4-amino-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(thiazol-2-yl)acetamide
CID 7579802
N-[4-methyl-5-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]acetamide;hydrobromide
CID 16194139
1-(pyridin-2-ylmethyl)-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 72002183
2-[4-(4-fluorophenyl)triazol-1-yl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 155510898

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide (CID 155536231) is 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide is O=C(Cn1cc(-c2ccncc2)nn1)Nc1nccs1.
What is the InChIKey of 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is TZDKUSLJUFFSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6OS/c19-11(15-12-14-5-6-20-12)8-18-7-10(16-17-18)9-1-3-13-4-2-9/h1-7H,8H2,(H,14,15,19).
What are the key properties of 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 286.32 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-4-yltriazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 155536231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).