2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide

C12H16N4OS — CID 110695347

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
SMILESCc1nc(NC(=O)Cc2c(C)n[nH]c2C)sc1C
InChIInChI=1S/C12H16N4OS/c1-6-9(4)18-12(13-6)14-11(17)5-10-7(2)15-16-8(10)3/h5H2,1-4H3,(H,15,16)(H,13,14,17)
InChIKeyCTPYPLSKCDQEBC-UHFFFAOYSA-N
MW264.35 g/mol
LogP2.28
Rot. Bonds3

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide (PubChem CID 110695347) has the molecular formula C12H16N4OS and a molecular weight of 264.35 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
PubChem CID110695347
Molecular FormulaC12H16N4OS
Molecular Weight264.35 g/mol
Exact Mass264.10
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
SMILESCc1nc(NC(=O)Cc2c(C)n[nH]c2C)sc1C
InChIInChI=1S/C12H16N4OS/c1-6-9(4)18-12(13-6)14-11(17)5-10-7(2)15-16-8(10)3/h5H2,1-4H3,(H,15,16)(H,13,14,17)
InChIKeyCTPYPLSKCDQEBC-UHFFFAOYSA-N
XLogP2.28
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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2-(2,4-dimethyl-1,3-oxazol-5-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
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5-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3-methylthiophene-2-carboxylic acid
CID 43356625
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N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-hydroxybutanamide
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CID 5181179
2-[2-(dimethylamino)ethylamino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
CID 7412309
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-hydroxy-2,3,5-trimethylphenyl)acetamide
CID 99829231
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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide (CID 110695347) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide is Cc1nc(NC(=O)Cc2c(C)n[nH]c2C)sc1C.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is CTPYPLSKCDQEBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4OS/c1-6-9(4)18-12(13-6)14-11(17)5-10-7(2)15-16-8(10)3/h5H2,1-4H3,(H,15,16)(H,13,14,17).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 264.35 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 110695347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).