4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide

C15H18N2O2S — CID 62148415

IUPAC4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-16-13-7-9-15(10-8-13)20(18,19)17-14-6-4-5-12(2)11-14/h4-11,16-17H,3H2,1-2H3
InChIKeyRYUXSHNCCWFIQW-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.23
Rot. Bonds5

About 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide

4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide (PubChem CID 62148415) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide
PubChem CID62148415
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-16-13-7-9-15(10-8-13)20(18,19)17-14-6-4-5-12(2)11-14/h4-11,16-17H,3H2,1-2H3
InChIKeyRYUXSHNCCWFIQW-UHFFFAOYSA-N
XLogP3.23
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
4-[(2S)-butan-2-yl]-N-(3-methylphenyl)benzenesulfonamide
CID 26012625
N-(2-bromo-5-methylphenyl)-4-(ethylamino)benzenesulfonamide
CID 82750328
N-ethyl-3-methylaniline;sulfuric acid
CID 161001051
4-methyl-N-[4-(3-methylanilino)phenyl]benzenesulfonamide
CID 112985985
N-ethyl-3-methylaniline;4-methylbenzenesulfonic acid
CID 162312873
N-(3-bromo-2-methylphenyl)-4-(ethylamino)benzenesulfonamide
CID 107630479
N-(2-chloro-4-methylphenyl)-4-(ethylamino)benzenesulfonamide
CID 62145281
2,5-dichloro-N-[4-[(3-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 989106
N-(3-methylphenyl)-3-[3-[(3-methylphenyl)sulfamoyl]phenyl]sulfonylbenzenesulfonamide
CID 3091379
4-(3-hydroxypropyl)-N-(3-methylphenyl)benzenesulfonamide
CID 39436095
N-(3-methylphenyl)naphthalene-2-sulfonamide
CID 965256

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide?
The IUPAC name of 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide (CID 62148415) is 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide?
The canonical SMILES for 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide is CCNc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1.
What is the InChIKey of 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide?
The InChIKey is RYUXSHNCCWFIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-3-16-13-7-9-15(10-8-13)20(18,19)17-14-6-4-5-12(2)11-14/h4-11,16-17H,3H2,1-2H3.
What are the key properties of 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide?
4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide has a molecular weight of 290.39 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(3-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 62148415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).