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

C20H23N3O3S — CID 42284907

IUPACN-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1cn(C(C)C)nc1-c1ccccc1
InChIInChI=1S/C20H23N3O3S/c1-4-26-18-13-9-8-12-17(18)22-27(24,25)19-14-23(15(2)3)21-20(19)16-10-6-5-7-11-16/h5-15,22H,4H2,1-3H3
InChIKeyPZAVFZDDFPYIRB-UHFFFAOYSA-N
MW385.49 g/mol
LogP4.33
Rot. Bonds7

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

N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide (PubChem CID 42284907) has the molecular formula C20H23N3O3S and a molecular weight of 385.49 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
PubChem CID42284907
Molecular FormulaC20H23N3O3S
Molecular Weight385.49 g/mol
Exact Mass385.15
IUPAC NameN-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1cn(C(C)C)nc1-c1ccccc1
InChIInChI=1S/C20H23N3O3S/c1-4-26-18-13-9-8-12-17(18)22-27(24,25)19-14-23(15(2)3)21-20(19)16-10-6-5-7-11-16/h5-15,22H,4H2,1-3H3
InChIKeyPZAVFZDDFPYIRB-UHFFFAOYSA-N
XLogP4.33
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.49
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42284905
N-(2-ethoxyphenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283333
N-benzyl-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346407
3-tert-butyl-N-(2-methoxyphenyl)-1-propan-2-ylpyrazole-4-sulfonamide
CID 42283900
3-phenyl-N-(2-phenylethyl)-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346454
3-phenyl-1-propan-2-yl-N-(pyridin-2-ylmethyl)pyrazole-4-sulfonamide
CID 42285555
N-[2-(dimethylamino)ethyl]-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42346316
3-phenyl-1-propan-2-yl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide
CID 42284900
3-methyl-N-[2-[[(2R)-oxan-2-yl]methoxy]phenyl]-1-propan-2-ylpyrazole-4-sulfonamide
CID 51598559
N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide
CID 7742393
N-(2-ethoxyphenyl)-2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonamide
CID 39847542
3-amino-N-(2-ethoxyphenyl)-2-methylbenzenesulfonamide
CID 30058477

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide (CID 42284907) is N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide is CCOc1ccccc1NS(=O)(=O)c1cn(C(C)C)nc1-c1ccccc1.
What is the InChIKey of N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
The InChIKey is PZAVFZDDFPYIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3S/c1-4-26-18-13-9-8-12-17(18)22-27(24,25)19-14-23(15(2)3)21-20(19)16-10-6-5-7-11-16/h5-15,22H,4H2,1-3H3.
What are the key properties of N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide?
N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide has a molecular weight of 385.49 g/mol, XLogP of 4.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 42284907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).