2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide

C13H22N2O3S — CID 106261839

IUPAC2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide
SMILESCCNCCS(=O)(=O)NCCc1ccccc1OC
InChIInChI=1S/C13H22N2O3S/c1-3-14-10-11-19(16,17)15-9-8-12-6-4-5-7-13(12)18-2/h4-7,14-15H,3,8-11H2,1-2H3
InChIKeyMPMOGRXUXZHUMP-UHFFFAOYSA-N
MW286.40 g/mol
LogP0.77
Rot. Bonds9

About 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide

2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide (PubChem CID 106261839) has the molecular formula C13H22N2O3S and a molecular weight of 286.40 g/mol. Its IUPAC name is 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide
PubChem CID106261839
Molecular FormulaC13H22N2O3S
Molecular Weight286.40 g/mol
Exact Mass286.14
IUPAC Name2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide
SMILESCCNCCS(=O)(=O)NCCc1ccccc1OC
InChIInChI=1S/C13H22N2O3S/c1-3-14-10-11-19(16,17)15-9-8-12-6-4-5-7-13(12)18-2/h4-7,14-15H,3,8-11H2,1-2H3
InChIKeyMPMOGRXUXZHUMP-UHFFFAOYSA-N
XLogP0.77
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[2-(2-methoxyphenyl)ethylsulfamoyl]propanoic acid
CID 28514163
2-(4-ethylphenoxy)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide
CID 90518814
2,2,2-trifluoro-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide
CID 143860168
2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113219093
1-[2-(ethylsulfonylamino)ethyl]-3-[2-(2-methoxyphenyl)ethyl]-2-methylguanidine;hydroiodide
CID 111340052
N-[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]propane-1-sulfonamide
CID 110324093
2-[2-(2-methoxyphenyl)ethylsulfamoyl]butanethioamide
CID 106261341
5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide
CID 87031963
2-(ethylamino)-N-(2-propylphenyl)ethanesulfonamide
CID 54972905
1-[3-(ethylsulfonylamino)propyl]-3-[2-(2-methoxyphenyl)ethyl]-2-methylguanidine;hydroiodide
CID 111340180
2-(ethylamino)-N-[2-(methoxymethyl)phenyl]ethanesulfonamide
CID 54972159
N-[2-(2-methoxy-4-propan-2-ylphenyl)ethyl]propane-1-sulfonamide
CID 110789542

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide?
The IUPAC name of 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide (CID 106261839) is 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide?
The canonical SMILES for 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide is CCNCCS(=O)(=O)NCCc1ccccc1OC.
What is the InChIKey of 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide?
The InChIKey is MPMOGRXUXZHUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3S/c1-3-14-10-11-19(16,17)15-9-8-12-6-4-5-7-13(12)18-2/h4-7,14-15H,3,8-11H2,1-2H3.
What are the key properties of 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide?
2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide has a molecular weight of 286.40 g/mol, XLogP of 0.77, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]ethanesulfonamide is sourced from PubChem (CID 106261839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).