N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide

C19H21N3O3S — CID 42284905

IUPACN-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2cn(C(C)C)nc2-c2ccccc2)c1
InChIInChI=1S/C19H21N3O3S/c1-14(2)22-13-18(19(20-22)15-8-5-4-6-9-15)26(23,24)21-16-10-7-11-17(12-16)25-3/h4-14,21H,1-3H3
InChIKeyZQNKELZDGXTEJY-UHFFFAOYSA-N
MW371.46 g/mol
LogP3.94
Rot. Bonds6

About N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide

N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide (PubChem CID 42284905) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
PubChem CID42284905
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC NameN-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2cn(C(C)C)nc2-c2ccccc2)c1
InChIInChI=1S/C19H21N3O3S/c1-14(2)22-13-18(19(20-22)15-8-5-4-6-9-15)26(23,24)21-16-10-7-11-17(12-16)25-3/h4-14,21H,1-3H3
InChIKeyZQNKELZDGXTEJY-UHFFFAOYSA-N
XLogP3.94
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-phenyl-1-propan-2-yl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide
CID 42284900
N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42284907
N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 122220853
N-benzyl-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346407
3-methyl-N-(4-phenoxyphenyl)-1-propan-2-ylpyrazole-4-sulfonamide
CID 42282486
N-(4-phenoxyphenyl)-1-propan-2-yl-3-thiophen-2-ylpyrazole-4-sulfonamide
CID 42285273
3-phenyl-N-(2-phenylethyl)-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346454
N-[2-(dimethylamino)ethyl]-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346316
N-(3,4-dimethylphenyl)-1-methyl-3-phenylpyrazole-4-sulfonamide
CID 42284845
8-hydroxy-N-(3-methoxyphenyl)quinoline-4-sulfonamide
CID 11158687
N-[3-[(3-methyl-1-propan-2-ylpyrazol-4-yl)sulfonylamino]phenyl]acetamide
CID 42282551
N-(4-anilinophenyl)-1-propan-2-yl-3-thiophen-2-ylpyrazole-4-sulfonamide
CID 42285313

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The IUPAC name of N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide (CID 42284905) is N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The canonical SMILES for N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide is COc1cccc(NS(=O)(=O)c2cn(C(C)C)nc2-c2ccccc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The InChIKey is ZQNKELZDGXTEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-14(2)22-13-18(19(20-22)15-8-5-4-6-9-15)26(23,24)21-16-10-7-11-17(12-16)25-3/h4-14,21H,1-3H3.
What are the key properties of N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide has a molecular weight of 371.46 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 42284905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).