N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide

C22H24N4O3S — CID 166288271

IUPACN-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(S(=O)(=O)NCc3cc(C4CC4)nn3C)cc2)cc1
InChIInChI=1S/C22H24N4O3S/c1-15(27)24-19-9-5-16(6-10-19)17-7-11-21(12-8-17)30(28,29)23-14-20-13-22(18-3-4-18)25-26(20)2/h5-13,18,23H,3-4,14H2,1-2H3,(H,24,27)
InChIKeyAMDAALWFSFEJES-UHFFFAOYSA-N
MW424.53 g/mol
LogP3.40
Rot. Bonds7

About N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide

N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide (PubChem CID 166288271) has the molecular formula C22H24N4O3S and a molecular weight of 424.53 g/mol. Its IUPAC name is N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide
PubChem CID166288271
Molecular FormulaC22H24N4O3S
Molecular Weight424.53 g/mol
Exact Mass424.16
IUPAC NameN-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(S(=O)(=O)NCc3cc(C4CC4)nn3C)cc2)cc1
InChIInChI=1S/C22H24N4O3S/c1-15(27)24-19-9-5-16(6-10-19)17-7-11-21(12-8-17)30(28,29)23-14-20-13-22(18-3-4-18)25-26(20)2/h5-13,18,23H,3-4,14H2,1-2H3,(H,24,27)
InChIKeyAMDAALWFSFEJES-UHFFFAOYSA-N
XLogP3.40
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.53
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(1,3,5-trimethylpyrazol-4-yl)methylsulfamoyl]phenyl]acetamide
CID 22209486
N-[4-[4-[(1-acetylpiperidin-4-yl)methylsulfamoyl]phenyl]phenyl]acetamide
CID 166195615
N-[4-[(1,2,5-trimethylpyrrol-3-yl)methylsulfamoyl]phenyl]acetamide
CID 110642115
N-[4-[(4-methylphenyl)methylsulfamoyl]phenyl]acetamide
CID 669174
N-[4-[2-[cyclopropyl(methylsulfonyl)amino]ethylsulfamoyl]phenyl]acetamide
CID 113065192
N-[4-[[(2R,4R,5R)-5-[3-(4-fluorophenyl)-1-methylpyrazol-5-yl]-1-azabicyclo[2.2.2]octan-2-yl]methylsulfamoyl]phenyl]acetamide
CID 162796757
[4-[[(4-acetamidophenyl)sulfonylamino]methyl]phenyl]methyl-dimethylazanium
CID 9191327
N-[4-[4-[cyclopropyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]phenyl]phenyl]acetamide
CID 166288275
N-[4-[2-(cycloheptylamino)ethylsulfamoyl]phenyl]acetamide;hydrochloride
CID 119987153
N-[4-[(2,3,4-trifluorophenyl)methylsulfamoyl]phenyl]acetamide
CID 74226496
N-[4-[(2-amino-2-cyclopropylethyl)sulfamoyl]phenyl]acetamide
CID 63764900
N-[4-[[4-(pyrrolidin-1-ylmethyl)phenyl]methylsulfamoyl]phenyl]acetamide
CID 26531816

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide?
The IUPAC name of N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide (CID 166288271) is N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide?
The canonical SMILES for N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide is CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)NCc3cc(C4CC4)nn3C)cc2)cc1.
What is the InChIKey of N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide?
The InChIKey is AMDAALWFSFEJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3S/c1-15(27)24-19-9-5-16(6-10-19)17-7-11-21(12-8-17)30(28,29)23-14-20-13-22(18-3-4-18)25-26(20)2/h5-13,18,23H,3-4,14H2,1-2H3,(H,24,27).
What are the key properties of N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide?
N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide has a molecular weight of 424.53 g/mol, XLogP of 3.40, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[(3-cyclopropyl-1-methylpyrazol-5-yl)methylsulfamoyl]phenyl]phenyl]acetamide is sourced from PubChem (CID 166288271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).