4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide

C14H24N2O2S — CID 43506894

IUPAC4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide
SMILESCCNC(C)c1ccc(S(=O)(=O)N(C)C(C)C)cc1
InChIInChI=1S/C14H24N2O2S/c1-6-15-12(4)13-7-9-14(10-8-13)19(17,18)16(5)11(2)3/h7-12,15H,6H2,1-5H3
InChIKeyFKGOHPZVERTWAR-UHFFFAOYSA-N
MW284.43 g/mol
LogP2.39
Rot. Bonds6

About 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide

4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide (PubChem CID 43506894) has the molecular formula C14H24N2O2S and a molecular weight of 284.43 g/mol. Its IUPAC name is 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide
PubChem CID43506894
Molecular FormulaC14H24N2O2S
Molecular Weight284.43 g/mol
Exact Mass284.16
IUPAC Name4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide
SMILESCCNC(C)c1ccc(S(=O)(=O)N(C)C(C)C)cc1
InChIInChI=1S/C14H24N2O2S/c1-6-15-12(4)13-7-9-14(10-8-13)19(17,18)16(5)11(2)3/h7-12,15H,6H2,1-5H3
InChIKeyFKGOHPZVERTWAR-UHFFFAOYSA-N
XLogP2.39
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutan-2-yl)benzenesulfonamide
CID 43570487
4-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylsulfanylpropan-2-yl)benzenesulfonamide
CID 115986126
4-[1-(ethylamino)ethyl]-N-methyl-N-propylbenzenesulfonamide
CID 43507083
2-[ethyl-[4-[1-(ethylamino)ethyl]phenyl]sulfonylamino]acetamide
CID 103102881
4-[1-(butylamino)ethyl]-N,N-dimethylbenzenesulfonamide
CID 60960679
4-[1-(2-hydroxybutylamino)ethyl]-N,N-dimethylbenzenesulfonamide
CID 115900312
N-[1-(4-ethoxyphenyl)ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55490961
4-[1-(3-hydroxypentylamino)ethyl]-N,N-dimethylbenzenesulfonamide
CID 115729207
N,N-diethyl-4-[1-(2-hydroxyethylamino)ethyl]benzenesulfonamide
CID 111750198
4-[1-(3,3-dimethylbutylamino)ethyl]-N,N-dimethylbenzenesulfonamide
CID 115676311
N,N-dimethyl-4-[(1S)-1-[(4-propan-2-ylphenyl)methylamino]ethyl]benzenesulfonamide
CID 94195074
4-[1-(ethylamino)ethyl]-N-methyl-N-(2-methylsulfonylethyl)aniline
CID 79850828

Frequently Asked Questions

What is the IUPAC name of 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide?
The IUPAC name of 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide (CID 43506894) is 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide?
The canonical SMILES for 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide is CCNC(C)c1ccc(S(=O)(=O)N(C)C(C)C)cc1.
What is the InChIKey of 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide?
The InChIKey is FKGOHPZVERTWAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-6-15-12(4)13-7-9-14(10-8-13)19(17,18)16(5)11(2)3/h7-12,15H,6H2,1-5H3.
What are the key properties of 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide?
4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide has a molecular weight of 284.43 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-ylbenzenesulfonamide is sourced from PubChem (CID 43506894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).