5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide

C16H18ClN3O3S — CID 5010173

IUPAC5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide
SMILESNc1ccc(N2CCOCC2)c(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C16H18ClN3O3S/c17-13-3-1-2-4-14(13)19-24(21,22)16-11-12(18)5-6-15(16)20-7-9-23-10-8-20/h1-6,11,19H,7-10,18H2
InChIKeyOPQBCYUORLCLHU-UHFFFAOYSA-N
MW367.86 g/mol
LogP2.56
Rot. Bonds4

About 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide

5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide (PubChem CID 5010173) has the molecular formula C16H18ClN3O3S and a molecular weight of 367.86 g/mol. Its IUPAC name is 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide.

Molecular Properties

Compound Name5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide
PubChem CID5010173
Molecular FormulaC16H18ClN3O3S
Molecular Weight367.86 g/mol
Exact Mass367.08
IUPAC Name5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide
SMILESNc1ccc(N2CCOCC2)c(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C16H18ClN3O3S/c17-13-3-1-2-4-14(13)19-24(21,22)16-11-12(18)5-6-15(16)20-7-9-23-10-8-20/h1-6,11,19H,7-10,18H2
InChIKeyOPQBCYUORLCLHU-UHFFFAOYSA-N
XLogP2.56
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.86
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide 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

5-Amino-N-(4-chloro-phenyl)-2-piperidin-1-yl-benzenesulfonamide
CID 3422328
3-amino-N-(4-chlorophenyl)-4-(morpholin-4-yl)benzene-1-sulfonamide
CID 3875844
ethyl N-[3-[(4-chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]carbamate
CID 4072808
N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
CID 4851806
5-Amino-N-(2-chloro-phenyl)-2-piperidin-1-yl-benzenesulfonamide
CID 3767555
3-amino-N-(2,5-dichlorophenyl)-4-(morpholin-4-yl)benzene-1-sulfonamide
CID 3866644
3-chloro-4-fluoro-N-(2-morpholinophenyl)benzenesulfonamide
CID 2813491
1-[3-[(2-Chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]-3-prop-2-enylthiourea
CID 3635236
5-amino-N-(2,5-dichlorophenyl)-2-(morpholin-4-yl)benzene-1-sulfonamide
CID 3870175
N-[3-[(4-chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]propanamide
CID 4424826
4-chloro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
CID 4794708
1-[3-[(4-Chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]-3-(2-methoxyethyl)thiourea
CID 4854225

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide?
The IUPAC name of 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide (CID 5010173) is 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide.
What is the SMILES notation for 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide?
The canonical SMILES for 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide is Nc1ccc(N2CCOCC2)c(S(=O)(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide?
The InChIKey is OPQBCYUORLCLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O3S/c17-13-3-1-2-4-14(13)19-24(21,22)16-11-12(18)5-6-15(16)20-7-9-23-10-8-20/h1-6,11,19H,7-10,18H2.
What are the key properties of 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide?
5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide has a molecular weight of 367.86 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide is sourced from PubChem (CID 5010173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).