N-(2-anilino-2-phenylethyl)benzenesulfonamide

C20H20N2O2S — CID 4076952

IUPACN-(2-anilino-2-phenylethyl)benzenesulfonamide
SMILESO=S(=O)(NCC(Nc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c23-25(24,19-14-8-3-9-15-19)21-16-20(17-10-4-1-5-11-17)22-18-12-6-2-7-13-18/h1-15,20-22H,16H2
InChIKeyYCNGGEPHSCUFJO-UHFFFAOYSA-N
MW352.46 g/mol
LogP3.82
Rot. Bonds7

About N-(2-anilino-2-phenylethyl)benzenesulfonamide

N-(2-anilino-2-phenylethyl)benzenesulfonamide (PubChem CID 4076952) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-(2-anilino-2-phenylethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-anilino-2-phenylethyl)benzenesulfonamide
PubChem CID4076952
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC NameN-(2-anilino-2-phenylethyl)benzenesulfonamide
SMILESO=S(=O)(NCC(Nc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c23-25(24,19-14-8-3-9-15-19)21-16-20(17-10-4-1-5-11-17)22-18-12-6-2-7-13-18/h1-15,20-22H,16H2
InChIKeyYCNGGEPHSCUFJO-UHFFFAOYSA-N
XLogP3.82
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-phenylethyl)benzenesulfonamide?
The IUPAC name of N-(2-anilino-2-phenylethyl)benzenesulfonamide (CID 4076952) is N-(2-anilino-2-phenylethyl)benzenesulfonamide.
What is the SMILES notation for N-(2-anilino-2-phenylethyl)benzenesulfonamide?
The canonical SMILES for N-(2-anilino-2-phenylethyl)benzenesulfonamide is O=S(=O)(NCC(Nc1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-anilino-2-phenylethyl)benzenesulfonamide?
The InChIKey is YCNGGEPHSCUFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c23-25(24,19-14-8-3-9-15-19)21-16-20(17-10-4-1-5-11-17)22-18-12-6-2-7-13-18/h1-15,20-22H,16H2.
What are the key properties of N-(2-anilino-2-phenylethyl)benzenesulfonamide?
N-(2-anilino-2-phenylethyl)benzenesulfonamide has a molecular weight of 352.46 g/mol, XLogP of 3.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-phenylethyl)benzenesulfonamide is sourced from PubChem (CID 4076952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).