2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

C16H12N6OS2 — CID 25344328

IUPAC2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESO=C(Cc1csc(-c2ccsc2)n1)Nc1ccc(-n2cncn2)nc1
InChIInChI=1S/C16H12N6OS2/c23-15(5-13-8-25-16(21-13)11-3-4-24-7-11)20-12-1-2-14(18-6-12)22-10-17-9-19-22/h1-4,6-10H,5H2,(H,20,23)
InChIKeyIWTVKCWNLYQNMQ-UHFFFAOYSA-N
MW368.45 g/mol
LogP3.03
Rot. Bonds5

About 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 25344328) has the molecular formula C16H12N6OS2 and a molecular weight of 368.45 g/mol. Its IUPAC name is 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
PubChem CID25344328
Molecular FormulaC16H12N6OS2
Molecular Weight368.45 g/mol
Exact Mass368.05
IUPAC Name2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESO=C(Cc1csc(-c2ccsc2)n1)Nc1ccc(-n2cncn2)nc1
InChIInChI=1S/C16H12N6OS2/c23-15(5-13-8-25-16(21-13)11-3-4-24-7-11)20-12-1-2-14(18-6-12)22-10-17-9-19-22/h1-4,6-10H,5H2,(H,20,23)
InChIKeyIWTVKCWNLYQNMQ-UHFFFAOYSA-N
XLogP3.03
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-(4-bromo-3-methylphenyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 8926939
N-[4-(ethylsulfonylamino)phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 55960719
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 26958590
2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 17497154
N-[3-chloro-4-(dimethylamino)phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 55825141
N-cyclopropyl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 17392861
3-(ethylamino)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]butanamide
CID 62839172
[2-(4-fluoroanilino)-2-oxoethyl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetate
CID 9129152
2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 35204280
N-(3-cyanophenyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 8927230
N-(3-oxo-4H-1,4-benzothiazin-6-yl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 37015475
N-methoxy-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 51279391

Frequently Asked Questions

What is the IUPAC name of 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (CID 25344328) is 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is O=C(Cc1csc(-c2ccsc2)n1)Nc1ccc(-n2cncn2)nc1.
What is the InChIKey of 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is IWTVKCWNLYQNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6OS2/c23-15(5-13-8-25-16(21-13)11-3-4-24-7-11)20-12-1-2-14(18-6-12)22-10-17-9-19-22/h1-4,6-10H,5H2,(H,20,23).
What are the key properties of 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 368.45 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 25344328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).