N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide

C14H23N3O3S — CID 43453904

IUPACN,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NCCN2CCOCC2)cc1
InChIInChI=1S/C14H23N3O3S/c1-16(2)21(18,19)14-5-3-13(4-6-14)15-7-8-17-9-11-20-12-10-17/h3-6,15H,7-12H2,1-2H3
InChIKeyZPSSNDBOWZSIAW-UHFFFAOYSA-N
MW313.42 g/mol
LogP0.68
Rot. Bonds6

About N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide

N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide (PubChem CID 43453904) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide
PubChem CID43453904
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC NameN,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NCCN2CCOCC2)cc1
InChIInChI=1S/C14H23N3O3S/c1-16(2)21(18,19)14-5-3-13(4-6-14)15-7-8-17-9-11-20-12-10-17/h3-6,15H,7-12H2,1-2H3
InChIKeyZPSSNDBOWZSIAW-UHFFFAOYSA-N
XLogP0.68
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-4-(morpholin-4-ylamino)benzenesulfonamide
CID 83025680
4-chloro-N-[4-(2-morpholin-4-ylethylamino)phenyl]benzenesulfonamide
CID 112981476
4-chloro-N-(2-morpholin-4-ylethyl)aniline
CID 28580807
2-[[4-(dimethylsulfamoyl)phenyl]methyl]-1-ethyl-3-(2-morpholin-4-ylethyl)guanidine;hydroiodide
CID 111187808
3-methyl-N-[4-(2-morpholin-4-ylethylamino)phenyl]benzenesulfonamide
CID 112981487
4-(2-hydroxyethylamino)-N,N-dimethylbenzenesulfonamide
CID 43453910
2-ethyl-N-[4-(2-morpholin-4-ylethylamino)phenyl]butanamide
CID 112981413
5-(dimethylsulfamoyl)-1-methyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 50802022
2-chloro-5-(dimethylsulfamoyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 8884146
4-(ethylamino)-N,N-dimethylbenzenesulfonamide
CID 43415076
3-fluoro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28583324
3-chloro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28568493

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide?
The IUPAC name of N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide (CID 43453904) is N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide?
The canonical SMILES for N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide is CN(C)S(=O)(=O)c1ccc(NCCN2CCOCC2)cc1.
What is the InChIKey of N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide?
The InChIKey is ZPSSNDBOWZSIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-16(2)21(18,19)14-5-3-13(4-6-14)15-7-8-17-9-11-20-12-10-17/h3-6,15H,7-12H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide?
N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide has a molecular weight of 313.42 g/mol, XLogP of 0.68, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide is sourced from PubChem (CID 43453904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).