N-(2-phenylpyrazol-3-yl)benzenesulfonamide

C15H13N3O2S — CID 10709273

IUPACN-(2-phenylpyrazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccnn1-c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13N3O2S/c19-21(20,14-9-5-2-6-10-14)17-15-11-12-16-18(15)13-7-3-1-4-8-13/h1-12,17H
InChIKeyGCRYKXLRCQDDAD-UHFFFAOYSA-N
MW299.36 g/mol
LogP2.67
Rot. Bonds4

About N-(2-phenylpyrazol-3-yl)benzenesulfonamide

N-(2-phenylpyrazol-3-yl)benzenesulfonamide (PubChem CID 10709273) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is N-(2-phenylpyrazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-phenylpyrazol-3-yl)benzenesulfonamide
PubChem CID10709273
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC NameN-(2-phenylpyrazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccnn1-c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13N3O2S/c19-21(20,14-9-5-2-6-10-14)17-15-11-12-16-18(15)13-7-3-1-4-8-13/h1-12,17H
InChIKeyGCRYKXLRCQDDAD-UHFFFAOYSA-N
XLogP2.67
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpyrazol-3-yl)benzenesulfonamide?
The IUPAC name of N-(2-phenylpyrazol-3-yl)benzenesulfonamide (CID 10709273) is N-(2-phenylpyrazol-3-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-phenylpyrazol-3-yl)benzenesulfonamide?
The canonical SMILES for N-(2-phenylpyrazol-3-yl)benzenesulfonamide is O=S(=O)(Nc1ccnn1-c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-phenylpyrazol-3-yl)benzenesulfonamide?
The InChIKey is GCRYKXLRCQDDAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c19-21(20,14-9-5-2-6-10-14)17-15-11-12-16-18(15)13-7-3-1-4-8-13/h1-12,17H.
What are the key properties of N-(2-phenylpyrazol-3-yl)benzenesulfonamide?
N-(2-phenylpyrazol-3-yl)benzenesulfonamide has a molecular weight of 299.36 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpyrazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 10709273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).