N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide

C19H19N3O4S — CID 11545489

IUPACN-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
SMILESCOc1ccc(S(=O)(=O)NC(=O)Cc2cc(C)nn2-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O4S/c1-14-12-16(22(20-14)15-6-4-3-5-7-15)13-19(23)21-27(24,25)18-10-8-17(26-2)9-11-18/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyVFLGMWLVRJLYLN-UHFFFAOYSA-N
MW385.45 g/mol
LogP2.24
Rot. Bonds6

About N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide

N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide (PubChem CID 11545489) has the molecular formula C19H19N3O4S and a molecular weight of 385.45 g/mol. Its IUPAC name is N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
PubChem CID11545489
Molecular FormulaC19H19N3O4S
Molecular Weight385.45 g/mol
Exact Mass385.11
IUPAC NameN-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
SMILESCOc1ccc(S(=O)(=O)NC(=O)Cc2cc(C)nn2-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O4S/c1-14-12-16(22(20-14)15-6-4-3-5-7-15)13-19(23)21-27(24,25)18-10-8-17(26-2)9-11-18/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyVFLGMWLVRJLYLN-UHFFFAOYSA-N
XLogP2.24
TPSA90.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-butylphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 11640195
2-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-N-(4-chlorophenyl)sulfonylacetamide
CID 11517452
N-(4-chlorophenyl)sulfonyl-2-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]acetamide;N-(4-chlorophenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide;N-(4-cyanophenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 87894255
1-(4-methoxyphenyl)-3-methyl-5-(2-phenylethyl)pyrazole
CID 15505631
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-methoxybenzenesulfonamide
CID 51284216
N-(benzenesulfonyl)-2-(3-methoxyphenyl)acetamide
CID 139754173
methyl 4-[(5-methyl-2-phenylpyrazol-3-yl)sulfamoyl]benzoate
CID 138994557
[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 4-methoxybenzoate
CID 7872728
ethyl 5-[(4-methoxyphenyl)sulfonylamino]-1-phenylpyrazole-4-carboxylate
CID 5065328
N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide
CID 166234668
4-methoxy-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzenesulfonamide
CID 108783992
benzyl N-(4-methoxyphenyl)sulfonylcarbamate
CID 122231425

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide (CID 11545489) is N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide is COc1ccc(S(=O)(=O)NC(=O)Cc2cc(C)nn2-c2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide?
The InChIKey is VFLGMWLVRJLYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4S/c1-14-12-16(22(20-14)15-6-4-3-5-7-15)13-19(23)21-27(24,25)18-10-8-17(26-2)9-11-18/h3-12H,13H2,1-2H3,(H,21,23).
What are the key properties of N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide?
N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide has a molecular weight of 385.45 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 11545489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).