2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

C11H14N4OS — CID 35335353

IUPAC2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cc(C)n(CC(=O)Nc2ncc(C)s2)n1
InChIInChI=1S/C11H14N4OS/c1-7-4-8(2)15(14-7)6-10(16)13-11-12-5-9(3)17-11/h4-5H,6H2,1-3H3,(H,12,13,16)
InChIKeyWDXJOHLTIQDKPA-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.90
Rot. Bonds3

About 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 35335353) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID35335353
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cc(C)n(CC(=O)Nc2ncc(C)s2)n1
InChIInChI=1S/C11H14N4OS/c1-7-4-8(2)15(14-7)6-10(16)13-11-12-5-9(3)17-11/h4-5H,6H2,1-3H3,(H,12,13,16)
InChIKeyWDXJOHLTIQDKPA-UHFFFAOYSA-N
XLogP1.90
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 35335353) is 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is Cc1cc(C)n(CC(=O)Nc2ncc(C)s2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is WDXJOHLTIQDKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-7-4-8(2)15(14-7)6-10(16)13-11-12-5-9(3)17-11/h4-5H,6H2,1-3H3,(H,12,13,16).
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 250.33 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 35335353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).