2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

C9H10N4OS — CID 3553941

IUPAC2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2ccnn2C)n1
InChIInChI=1S/C9H10N4OS/c1-6-5-15-9(11-6)12-8(14)7-3-4-10-13(7)2/h3-5H,1-2H3,(H,11,12,14)
InChIKeyLILUXOCTFUVKIV-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.44
Rot. Bonds2

About 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (PubChem CID 3553941) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
PubChem CID3553941
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC Name2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2ccnn2C)n1
InChIInChI=1S/C9H10N4OS/c1-6-5-15-9(11-6)12-8(14)7-3-4-10-13(7)2/h3-5H,1-2H3,(H,11,12,14)
InChIKeyLILUXOCTFUVKIV-UHFFFAOYSA-N
XLogP1.44
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The IUPAC name of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (CID 3553941) is 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is Cc1csc(NC(=O)c2ccnn2C)n1.
What is the InChIKey of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The InChIKey is LILUXOCTFUVKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-6-5-15-9(11-6)12-8(14)7-3-4-10-13(7)2/h3-5H,1-2H3,(H,11,12,14).
What are the key properties of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide has a molecular weight of 222.27 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 3553941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).