N-[1-(4-methylphenyl)ethyl]benzenesulfonamide

C15H17NO2S — CID 3277743

IUPACN-[1-(4-methylphenyl)ethyl]benzenesulfonamide
SMILESCc1ccc(C(C)NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C15H17NO2S/c1-12-8-10-14(11-9-12)13(2)16-19(17,18)15-6-4-3-5-7-15/h3-11,13,16H,1-2H3
InChIKeyRTAFXPCZSQDRRQ-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.03
Rot. Bonds4

About N-[1-(4-methylphenyl)ethyl]benzenesulfonamide

N-[1-(4-methylphenyl)ethyl]benzenesulfonamide (PubChem CID 3277743) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)ethyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)ethyl]benzenesulfonamide
PubChem CID3277743
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC NameN-[1-(4-methylphenyl)ethyl]benzenesulfonamide
SMILESCc1ccc(C(C)NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C15H17NO2S/c1-12-8-10-14(11-9-12)13(2)16-19(17,18)15-6-4-3-5-7-15/h3-11,13,16H,1-2H3
InChIKeyRTAFXPCZSQDRRQ-UHFFFAOYSA-N
XLogP3.03
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-methylphenyl)ethyl]benzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-Cyclohexyl-4-methylbenzenesulfonamide
CID 6633
p-Toluenesulfonamide, N-benzyl-
CID 95801
Benzenesulfonamide, N-benzyl-
CID 95236
(2-Cyclohex-1-enylethyl)[(4-methylphenyl)sulfonyl]amine
CID 737669
4-[1-(Methylamino)ethyl]benzene-1-sulfonamide
CID 4961836
4-(Benzenesulfonamidomethyl)benzene-1-sulfonamide
CID 724642
4-{2-[(Phenylsulfonyl)amino]ethyl}benzenesulfonamide
CID 2217668
2,4,6-Trimethyl-N-phenethyl-1-benzenesulfonamide
CID 3109779
3-methyl-N-phenethylbenzenesulfonamide
CID 890664
4-methyl-N-pentan-2-ylbenzenesulfonamide
CID 3703019
N-cyclooctyl-4-methylbenzenesulfonamide
CID 260972
N-(1-Phenylethyl)methanesulfonamide
CID 380740

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)ethyl]benzenesulfonamide?
The IUPAC name of N-[1-(4-methylphenyl)ethyl]benzenesulfonamide (CID 3277743) is N-[1-(4-methylphenyl)ethyl]benzenesulfonamide.
What is the SMILES notation for N-[1-(4-methylphenyl)ethyl]benzenesulfonamide?
The canonical SMILES for N-[1-(4-methylphenyl)ethyl]benzenesulfonamide is Cc1ccc(C(C)NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)ethyl]benzenesulfonamide?
The InChIKey is RTAFXPCZSQDRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-12-8-10-14(11-9-12)13(2)16-19(17,18)15-6-4-3-5-7-15/h3-11,13,16H,1-2H3.
What are the key properties of N-[1-(4-methylphenyl)ethyl]benzenesulfonamide?
N-[1-(4-methylphenyl)ethyl]benzenesulfonamide has a molecular weight of 275.37 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)ethyl]benzenesulfonamide is sourced from PubChem (CID 3277743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).