N-ethyl-N-naphthalen-1-ylbenzenesulfonamide

C18H17NO2S — CID 2815478

IUPACN-ethyl-N-naphthalen-1-ylbenzenesulfonamide
SMILESCCN(c1cccc2ccccc12)S(=O)(=O)c1ccccc1
InChIInChI=1S/C18H17NO2S/c1-2-19(22(20,21)16-11-4-3-5-12-16)18-14-8-10-15-9-6-7-13-17(15)18/h3-14H,2H2,1H3
InChIKeyWYZWBJIPTSCACL-UHFFFAOYSA-N
MW311.41 g/mol
LogP4.05
Rot. Bonds4

About N-ethyl-N-naphthalen-1-ylbenzenesulfonamide

N-ethyl-N-naphthalen-1-ylbenzenesulfonamide (PubChem CID 2815478) has the molecular formula C18H17NO2S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-ethyl-N-naphthalen-1-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-naphthalen-1-ylbenzenesulfonamide
PubChem CID2815478
Molecular FormulaC18H17NO2S
Molecular Weight311.41 g/mol
Exact Mass311.10
IUPAC NameN-ethyl-N-naphthalen-1-ylbenzenesulfonamide
SMILESCCN(c1cccc2ccccc12)S(=O)(=O)c1ccccc1
InChIInChI=1S/C18H17NO2S/c1-2-19(22(20,21)16-11-4-3-5-12-16)18-14-8-10-15-9-6-7-13-17(15)18/h3-14H,2H2,1H3
InChIKeyWYZWBJIPTSCACL-UHFFFAOYSA-N
XLogP4.05
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-naphthalen-1-ylbenzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-naphthalen-1-ylbenzenesulfonamide?
The IUPAC name of N-ethyl-N-naphthalen-1-ylbenzenesulfonamide (CID 2815478) is N-ethyl-N-naphthalen-1-ylbenzenesulfonamide.
What is the SMILES notation for N-ethyl-N-naphthalen-1-ylbenzenesulfonamide?
The canonical SMILES for N-ethyl-N-naphthalen-1-ylbenzenesulfonamide is CCN(c1cccc2ccccc12)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-ethyl-N-naphthalen-1-ylbenzenesulfonamide?
The InChIKey is WYZWBJIPTSCACL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2S/c1-2-19(22(20,21)16-11-4-3-5-12-16)18-14-8-10-15-9-6-7-13-17(15)18/h3-14H,2H2,1H3.
What are the key properties of N-ethyl-N-naphthalen-1-ylbenzenesulfonamide?
N-ethyl-N-naphthalen-1-ylbenzenesulfonamide has a molecular weight of 311.41 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-naphthalen-1-ylbenzenesulfonamide is sourced from PubChem (CID 2815478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).