2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide

C9H10N4O2S — CID 43429562

IUPAC2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)Nc1cn[nH]c1
InChIInChI=1S/C9H10N4O2S/c1-6-5-16-9(15)13(6)4-8(14)12-7-2-10-11-3-7/h2-3,5H,4H2,1H3,(H,10,11)(H,12,14)
InChIKeyXULOSLQSMDGZNS-UHFFFAOYSA-N
MW238.27 g/mol
LogP0.58
Rot. Bonds3

About 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide

2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide (PubChem CID 43429562) has the molecular formula C9H10N4O2S and a molecular weight of 238.27 g/mol. Its IUPAC name is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide
PubChem CID43429562
Molecular FormulaC9H10N4O2S
Molecular Weight238.27 g/mol
Exact Mass238.05
IUPAC Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)Nc1cn[nH]c1
InChIInChI=1S/C9H10N4O2S/c1-6-5-16-9(15)13(6)4-8(14)12-7-2-10-11-3-7/h2-3,5H,4H2,1H3,(H,10,11)(H,12,14)
InChIKeyXULOSLQSMDGZNS-UHFFFAOYSA-N
XLogP0.58
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide (CID 43429562) is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide is Cc1csc(=O)n1CC(=O)Nc1cn[nH]c1.
What is the InChIKey of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide?
The InChIKey is XULOSLQSMDGZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2S/c1-6-5-16-9(15)13(6)4-8(14)12-7-2-10-11-3-7/h2-3,5H,4H2,1H3,(H,10,11)(H,12,14).
What are the key properties of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide?
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide has a molecular weight of 238.27 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 43429562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).