N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide

C11H12N4O2S — CID 134048750

IUPACN-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(=O)c1csc(NC(=O)C(C)n2cccn2)n1
InChIInChI=1S/C11H12N4O2S/c1-7(15-5-3-4-12-15)10(17)14-11-13-9(6-18-11)8(2)16/h3-7H,1-2H3,(H,13,14,17)
InChIKeyZTQPAASVRKJVNI-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.74
Rot. Bonds4

About N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide

N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide (PubChem CID 134048750) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
PubChem CID134048750
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC NameN-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(=O)c1csc(NC(=O)C(C)n2cccn2)n1
InChIInChI=1S/C11H12N4O2S/c1-7(15-5-3-4-12-15)10(17)14-11-13-9(6-18-11)8(2)16/h3-7H,1-2H3,(H,13,14,17)
InChIKeyZTQPAASVRKJVNI-UHFFFAOYSA-N
XLogP1.74
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-pyrazol-1-ylpropanamide
CID 43055174
N-(5-acetyl-4-phenyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
CID 134060555
(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
CID 35556893
N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)propanamide
CID 116678104
2-pyrazol-1-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide
CID 86768177
N-(4-acetyl-1,3-thiazol-2-yl)-2-propylpentanamide
CID 115532303
(2R)-N-[2,4-difluoro-5-[[(2S)-2-pyrazol-1-ylpropanoyl]amino]phenyl]-2-pyrazol-1-ylpropanamide
CID 97320876
(2S)-N-(4-acetyl-1,3-thiazol-2-yl)-2-amino-3,3-dimethylbutanamide
CID 64557720
4-[(4-acetyl-1,3-thiazol-2-yl)amino]-3-amino-4-oxobutanoic acid
CID 64896566
N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
CID 47187700
N-(3-acetamidophenyl)-2-pyrazol-1-ylpropanamide
CID 134060380
N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 134060372

Frequently Asked Questions

What is the IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide (CID 134048750) is N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide is CC(=O)c1csc(NC(=O)C(C)n2cccn2)n1.
What is the InChIKey of N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
The InChIKey is ZTQPAASVRKJVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-7(15-5-3-4-12-15)10(17)14-11-13-9(6-18-11)8(2)16/h3-7H,1-2H3,(H,13,14,17).
What are the key properties of N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide?
N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide has a molecular weight of 264.31 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 134048750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).