N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide

C11H26N2O2S — CID 115306037

IUPACN-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide
SMILESCCC(N)(CC)CNS(=O)(=O)CC(C)(C)C
InChIInChI=1S/C11H26N2O2S/c1-6-11(12,7-2)8-13-16(14,15)9-10(3,4)5/h13H,6-9,12H2,1-5H3
InChIKeyZAFXRMVYISCKEA-UHFFFAOYSA-N
MW250.41 g/mol
LogP1.47
Rot. Bonds6

About N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide

N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide (PubChem CID 115306037) has the molecular formula C11H26N2O2S and a molecular weight of 250.41 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide
PubChem CID115306037
Molecular FormulaC11H26N2O2S
Molecular Weight250.41 g/mol
Exact Mass250.17
IUPAC NameN-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide
SMILESCCC(N)(CC)CNS(=O)(=O)CC(C)(C)C
InChIInChI=1S/C11H26N2O2S/c1-6-11(12,7-2)8-13-16(14,15)9-10(3,4)5/h13H,6-9,12H2,1-5H3
InChIKeyZAFXRMVYISCKEA-UHFFFAOYSA-N
XLogP1.47
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-ethylbutyl)propane-2-sulfonamide
CID 115306044
2-[(2-amino-2-ethylbutyl)sulfamoyl]acetic acid
CID 115305990
N-(2-amino-2-methylpropyl)ethanesulfonamide
CID 115303418
N-(2-amino-2-ethylbutyl)-1-(3-methylphenyl)methanesulfonamide
CID 119989766
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-2,2-dimethylpropane-1-sulfonamide
CID 106245535
N-(2-amino-2-ethylbutyl)-5-methyl-1H-pyrazole-4-sulfonamide;hydrochloride
CID 119999938
1-N-(cyclopropylsulfamoyl)-2-ethylbutane-1,2-diamine
CID 114811238
N-(2-amino-2-methylpropyl)butane-1-sulfonamide
CID 115303565
N-(2-amino-2-ethylbutyl)-5-bromo-2-methylbenzenesulfonamide
CID 115306000
N-(2-amino-2-ethylbutyl)-2-fluoro-4-methylbenzenesulfonamide
CID 119989897
3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride
CID 119989719
N-(2-amino-2-ethylbutyl)-4-fluoro-2,6-dimethylbenzenesulfonamide
CID 107328336

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide (CID 115306037) is N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide is CCC(N)(CC)CNS(=O)(=O)CC(C)(C)C.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide?
The InChIKey is ZAFXRMVYISCKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2S/c1-6-11(12,7-2)8-13-16(14,15)9-10(3,4)5/h13H,6-9,12H2,1-5H3.
What are the key properties of N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide?
N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide has a molecular weight of 250.41 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2,2-dimethylpropane-1-sulfonamide is sourced from PubChem (CID 115306037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).