N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide

C20H24N2O4S — CID 86984239

IUPACN-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide
SMILESCc1ccccc1C(C)NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-5-3-4-6-19(15)16(2)21-27(24,25)18-9-7-17(8-10-18)20(23)22-11-13-26-14-12-22/h3-10,16,21H,11-14H2,1-2H3
InChIKeyZUZJHXZNADUYKT-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.51
Rot. Bonds5

About N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide

N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide (PubChem CID 86984239) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide.

Molecular Properties

Compound NameN-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide
PubChem CID86984239
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC NameN-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide
SMILESCc1ccccc1C(C)NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-5-3-4-6-19(15)16(2)21-27(24,25)18-9-7-17(8-10-18)20(23)22-11-13-26-14-12-22/h3-10,16,21H,11-14H2,1-2H3
InChIKeyZUZJHXZNADUYKT-UHFFFAOYSA-N
XLogP2.51
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)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

4-(morpholine-4-carbonyl)-N-propan-2-ylbenzenesulfonamide
CID 27258350
N-[2-(methylamino)propyl]-4-(morpholine-4-carbonyl)benzenesulfonamide;hydrochloride
CID 120825215
N-(1-phenylethyl)-4-(piperidine-1-carbonyl)benzenesulfonamide
CID 109059411
N-(3-aminobutyl)-4-(morpholine-4-carbonyl)benzenesulfonamide
CID 119972328
N-(2-amino-1-cyclopropylethyl)-4-(morpholine-4-carbonyl)benzenesulfonamide
CID 119986557
4-bromo-N-[(1R)-1-(2-methylphenyl)ethyl]benzenesulfonamide
CID 26944548
2-[[(1R)-1-(2-methylphenyl)ethyl]amino]-1-morpholin-4-ylethanone
CID 81374136
4-methyl-N-[(1S,2R)-2-methyl-3-morpholin-4-yl-1-naphthalen-1-yl-3-oxopropyl]benzenesulfonamide
CID 24751692
4-(morpholine-4-carbonyl)benzenesulfonyl fluoride
CID 165461287
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzenesulfonamide
CID 109060714
3-acetyl-N-[1-(2-methylphenyl)ethyl]benzenesulfonamide
CID 51169549
4-ethoxy-N-[(1S)-1-(2-methylphenyl)ethyl]benzenesulfonamide
CID 8762877

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide?
The IUPAC name of N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide (CID 86984239) is N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide.
What is the SMILES notation for N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide?
The canonical SMILES for N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide is Cc1ccccc1C(C)NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide?
The InChIKey is ZUZJHXZNADUYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15-5-3-4-6-19(15)16(2)21-27(24,25)18-9-7-17(8-10-18)20(23)22-11-13-26-14-12-22/h3-10,16,21H,11-14H2,1-2H3.
What are the key properties of N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide?
N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide has a molecular weight of 388.49 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylphenyl)ethyl]-4-(morpholine-4-carbonyl)benzenesulfonamide is sourced from PubChem (CID 86984239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).