N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride

C10H16Cl2N2O2S — CID 119988011

IUPACN-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride
SMILESCC(C)(N)CNS(=O)(=O)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C10H15ClN2O2S.ClH/c1-10(2,12)7-13-16(14,15)9-5-3-8(11)4-6-9;/h3-6,13H,7,12H2,1-2H3;1H
InChIKeyQZKSAFMFBGDLJC-UHFFFAOYSA-N
MW299.22 g/mol
LogP1.78
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride

N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride (PubChem CID 119988011) has the molecular formula C10H16Cl2N2O2S and a molecular weight of 299.22 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride
PubChem CID119988011
Molecular FormulaC10H16Cl2N2O2S
Molecular Weight299.22 g/mol
Exact Mass298.03
IUPAC NameN-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride
SMILESCC(C)(N)CNS(=O)(=O)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C10H15ClN2O2S.ClH/c1-10(2,12)7-13-16(14,15)9-5-3-8(11)4-6-9;/h3-6,13H,7,12H2,1-2H3;1H
InChIKeyQZKSAFMFBGDLJC-UHFFFAOYSA-N
XLogP1.78
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.22
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-methylpropyl)-4-propan-2-ylbenzenesulfonamide;hydrochloride
CID 119988328
N-(2-amino-2-methylpropyl)-4-fluorobenzenesulfonamide;hydrochloride
CID 119988167
N-(2-amino-2-methylpropyl)benzenesulfonamide;hydrochloride
CID 90081725
1-N-(2-amino-2-methylpropyl)-4-N-(2,2,2-trifluoroethyl)benzene-1,4-disulfonamide
CID 119988277
N-(2-amino-2-methylpropyl)-4-nitrobenzenesulfonamide;hydrochloride
CID 119988012
N-(2-amino-2-methylpropyl)-4-methoxybenzenesulfonamide
CID 115303620
N-(2-amino-2-methylpropyl)-4-butan-2-ylbenzenesulfonamide;hydrochloride
CID 119987953
4-chloro-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzenesulfonamide chloride
CID 53350877
4-chloro-N-(2-hydroxy-3-methoxy-2-methylpropyl)benzenesulfonamide
CID 90501119
N-(2-amino-2-methylpropyl)-3-chloro-4-cyanobenzenesulfonamide;hydrochloride
CID 75431033
4-chloro-N-[2-ethyl-2-(hydroxymethyl)butyl]benzenesulfonamide
CID 103844707
N-(2-amino-2-methylpropyl)-4-(cyanomethyl)benzenesulfonamide
CID 113282753

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride (CID 119988011) is N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride is CC(C)(N)CNS(=O)(=O)c1ccc(Cl)cc1.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride?
The InChIKey is QZKSAFMFBGDLJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O2S.ClH/c1-10(2,12)7-13-16(14,15)9-5-3-8(11)4-6-9;/h3-6,13H,7,12H2,1-2H3;1H.
What are the key properties of N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride?
N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride has a molecular weight of 299.22 g/mol, XLogP of 1.78, 4 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)-4-chlorobenzenesulfonamide;hydrochloride is sourced from PubChem (CID 119988011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).