N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide

C17H16N4O3S — CID 3083651

IUPACN-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2-c2ccccc2)cc1
InChIInChI=1S/C17H16N4O3S/c1-13(22)19-14-7-9-16(10-8-14)25(23,24)20-17-11-12-18-21(17)15-5-3-2-4-6-15/h2-12,20H,1H3,(H,19,22)
InChIKeyPSFOMYYDCTXBHG-UHFFFAOYSA-N
MW356.41 g/mol
LogP2.63
Rot. Bonds5

About N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide

N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide (PubChem CID 3083651) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide
PubChem CID3083651
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC NameN-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2-c2ccccc2)cc1
InChIInChI=1S/C17H16N4O3S/c1-13(22)19-14-7-9-16(10-8-14)25(23,24)20-17-11-12-18-21(17)15-5-3-2-4-6-15/h2-12,20H,1H3,(H,19,22)
InChIKeyPSFOMYYDCTXBHG-UHFFFAOYSA-N
XLogP2.63
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide (CID 3083651) is N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2-c2ccccc2)cc1.
What is the InChIKey of N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is PSFOMYYDCTXBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c1-13(22)19-14-7-9-16(10-8-14)25(23,24)20-17-11-12-18-21(17)15-5-3-2-4-6-15/h2-12,20H,1H3,(H,19,22).
What are the key properties of N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 356.41 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 3083651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).