N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide

C13H16N4O3S — CID 22209149

IUPACN-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1
InChIInChI=1S/C13H16N4O3S/c1-9-13(8-14-17(9)3)16-21(19,20)12-6-4-11(5-7-12)15-10(2)18/h4-8,16H,1-3H3,(H,15,18)
InChIKeyRACVVMHXUIVZGD-UHFFFAOYSA-N
MW308.36 g/mol
LogP1.49
Rot. Bonds4

About N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide

N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide (PubChem CID 22209149) has the molecular formula C13H16N4O3S and a molecular weight of 308.36 g/mol. Its IUPAC name is N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide
PubChem CID22209149
Molecular FormulaC13H16N4O3S
Molecular Weight308.36 g/mol
Exact Mass308.09
IUPAC NameN-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1
InChIInChI=1S/C13H16N4O3S/c1-9-13(8-14-17(9)3)16-21(19,20)12-6-4-11(5-7-12)15-10(2)18/h4-8,16H,1-3H3,(H,15,18)
InChIKeyRACVVMHXUIVZGD-UHFFFAOYSA-N
XLogP1.49
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(1-ethyl-5-methylpyrazol-4-yl)sulfamoyl]phenyl]acetamide
CID 22209298
N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide
CID 22209123
3-[(4-acetamidophenyl)sulfonylamino]-4-methylbenzoic acid
CID 2975645
N-[4-[(4-acetamidophenyl)sulfonylsulfamoyl]phenyl]acetamide
CID 71349024
4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzenesulfonyl chloride
CID 43095846
N-[4-[(2-methoxy-4,5-dimethylphenyl)sulfamoyl]phenyl]acetamide
CID 110776847
N-[3-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]phenyl]acetamide
CID 22202614
1-methyl-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-4-nitropyrazole-5-carboxamide
CID 19579467
N-[4-[[4-(4-methylanilino)phenyl]sulfamoyl]phenyl]acetamide
CID 112986068
2-[(4-acetamidophenyl)sulfonylamino]benzoate
CID 7040069
2-[(4-acetamidophenyl)sulfonylamino]benzoic acid
CID 3863821
N-[4-[(1,3,5-trimethylpyrazol-4-yl)methylsulfamoyl]phenyl]acetamide
CID 22209486

Frequently Asked Questions

What is the IUPAC name of N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide (CID 22209149) is N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1.
What is the InChIKey of N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is RACVVMHXUIVZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O3S/c1-9-13(8-14-17(9)3)16-21(19,20)12-6-4-11(5-7-12)15-10(2)18/h4-8,16H,1-3H3,(H,15,18).
What are the key properties of N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 308.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 22209149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).