4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide

C13H23N3O5S2 — CID 120825303

IUPAC4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCC(C)NC)c(OC)c1
InChIInChI=1S/C13H23N3O5S2/c1-5-22(17,18)16-11-6-7-13(12(8-11)21-4)23(19,20)15-9-10(2)14-3/h6-8,10,14-16H,5,9H2,1-4H3
InChIKeyUMYPKYFENBWSHS-UHFFFAOYSA-N
MW365.48 g/mol
LogP0.34
Rot. Bonds9

About 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide

4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide (PubChem CID 120825303) has the molecular formula C13H23N3O5S2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide.

Molecular Properties

Compound Name4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide
PubChem CID120825303
Molecular FormulaC13H23N3O5S2
Molecular Weight365.48 g/mol
Exact Mass365.11
IUPAC Name4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCC(C)NC)c(OC)c1
InChIInChI=1S/C13H23N3O5S2/c1-5-22(17,18)16-11-6-7-13(12(8-11)21-4)23(19,20)15-9-10(2)14-3/h6-8,10,14-16H,5,9H2,1-4H3
InChIKeyUMYPKYFENBWSHS-UHFFFAOYSA-N
XLogP0.34
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]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-(4-aminobutyl)-4-(ethylsulfonylamino)-2-methoxybenzenesulfonamide
CID 120583580
N-(2-cyclopentylethyl)-4-(ethylsulfonylamino)-2-methoxybenzenesulfonamide
CID 75392991
2-fluoro-4,5-dimethoxy-N-[2-(methylamino)propyl]benzenesulfonamide
CID 120824947
5-chloro-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide;hydrochloride
CID 120824319
5-bromo-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide;hydrochloride
CID 120824611
2-fluoro-4-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide
CID 120824888
4-bromo-5-fluoro-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide;hydrochloride
CID 120825030
3,4-dimethoxy-N-[2-(methylamino)propyl]benzenesulfonamide;hydrochloride
CID 120824781
2-methoxy-4-(methylaminomethyl)-N-(2-methylpropyl)benzenesulfonamide
CID 102704468
2-[[4-(ethylsulfonylamino)-2-methoxyphenyl]sulfonylamino]-3-phenylpropanamide
CID 71906880
3-fluoro-4-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide
CID 120824953
2-methoxy-N-(2-methylpropyl)benzenesulfonamide
CID 47104188

Frequently Asked Questions

What is the IUPAC name of 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide?
The IUPAC name of 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide (CID 120825303) is 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide.
What is the SMILES notation for 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide?
The canonical SMILES for 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide is CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCC(C)NC)c(OC)c1.
What is the InChIKey of 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide?
The InChIKey is UMYPKYFENBWSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O5S2/c1-5-22(17,18)16-11-6-7-13(12(8-11)21-4)23(19,20)15-9-10(2)14-3/h6-8,10,14-16H,5,9H2,1-4H3.
What are the key properties of 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide?
4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide has a molecular weight of 365.48 g/mol, XLogP of 0.34, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfonylamino)-2-methoxy-N-[2-(methylamino)propyl]benzenesulfonamide is sourced from PubChem (CID 120825303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).