N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride

C12H21ClN2O2S — CID 120711490

IUPACN-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride
SMILESCCc1ccccc1S(=O)(=O)NCC(C)(C)N.Cl
InChIInChI=1S/C12H20N2O2S.ClH/c1-4-10-7-5-6-8-11(10)17(15,16)14-9-12(2,3)13;/h5-8,14H,4,9,13H2,1-3H3;1H
InChIKeyJHJXIHRZHOQSAN-UHFFFAOYSA-N
MW292.83 g/mol
LogP1.69
Rot. Bonds5

About N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride

N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride (PubChem CID 120711490) has the molecular formula C12H21ClN2O2S and a molecular weight of 292.83 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride
PubChem CID120711490
Molecular FormulaC12H21ClN2O2S
Molecular Weight292.83 g/mol
Exact Mass292.10
IUPAC NameN-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride
SMILESCCc1ccccc1S(=O)(=O)NCC(C)(C)N.Cl
InChIInChI=1S/C12H20N2O2S.ClH/c1-4-10-7-5-6-8-11(10)17(15,16)14-9-12(2,3)13;/h5-8,14H,4,9,13H2,1-3H3;1H
InChIKeyJHJXIHRZHOQSAN-UHFFFAOYSA-N
XLogP1.69
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.83
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride 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-(2-amino-2-ethylbutyl)-2-ethylbenzenesulfonamide;hydrochloride
CID 120711865
N-(2-amino-2-methylpropyl)-2-methylsulfanylbenzenesulfonamide;hydrochloride
CID 120711544
N-(2-amino-2-methylpropyl)benzenesulfonamide;hydrochloride
CID 90081725
N-(2-amino-2-methylpropyl)naphthalene-1-sulfonamide
CID 84591300
N-(2-amino-2-methylpropyl)-2-bromo-3-methylbenzenesulfonamide;hydrochloride
CID 119988009
2-ethyl-N-[2-(propylamino)ethyl]benzenesulfonamide
CID 120716001
2-(aminomethyl)-N-(2-methoxy-2-methylpropyl)benzenesulfonamide
CID 104759943
2-ethyl-N-(4-hydroxybut-2-ynyl)benzenesulfonamide
CID 127266845
N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride
CID 119987957
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(2-amino-2-methylpropyl)-2,5-dimethylbenzenesulfonamide;hydrochloride
CID 119988451
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-disulfonamide
CID 25048038

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride (CID 120711490) is N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride is CCc1ccccc1S(=O)(=O)NCC(C)(C)N.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride?
The InChIKey is JHJXIHRZHOQSAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S.ClH/c1-4-10-7-5-6-8-11(10)17(15,16)14-9-12(2,3)13;/h5-8,14H,4,9,13H2,1-3H3;1H.
What are the key properties of N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride?
N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride has a molecular weight of 292.83 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2-ethylbenzenesulfonamide;hydrochloride is sourced from PubChem (CID 120711490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).