N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide

C6H16N2O2S — CID 61124177

IUPACN-(1-amino-2-methylpropan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C6H16N2O2S/c1-4-11(9,10)8-6(2,3)5-7/h8H,4-5,7H2,1-3H3
InChIKeyAOXAJQISINPWBM-UHFFFAOYSA-N
MW180.27 g/mol
LogP-0.34
Rot. Bonds4

About N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide

N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide (PubChem CID 61124177) has the molecular formula C6H16N2O2S and a molecular weight of 180.27 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)ethanesulfonamide
PubChem CID61124177
Molecular FormulaC6H16N2O2S
Molecular Weight180.27 g/mol
Exact Mass180.09
IUPAC NameN-(1-amino-2-methylpropan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(C)(C)CN
InChIInChI=1S/C6H16N2O2S/c1-4-11(9,10)8-6(2,3)5-7/h8H,4-5,7H2,1-3H3
InChIKeyAOXAJQISINPWBM-UHFFFAOYSA-N
XLogP-0.34
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.27
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-ethoxyethanesulfonamide
CID 63246035
N-(1-amino-2-methylpropan-2-yl)-3-methylbutane-1-sulfonamide
CID 63834751
1-amino-2-[[ethyl(methyl)sulfamoyl]amino]-2-methylpropane;hydrochloride
CID 119975442
N-(1-methoxy-2-methylpropan-2-yl)ethanesulfonamide
CID 115617292
N-(1-amino-2,4-dimethylpentan-2-yl)ethanesulfonamide;hydrochloride
CID 119985245
N-(1-amino-2-methylpropan-2-yl)-2-phenylethanesulfonamide
CID 63194224
N-[2-[(1-amino-2-methylpropan-2-yl)sulfamoyl]ethyl]benzenesulfonamide
CID 119975856
N-(1-amino-2-methylpropan-2-yl)-1-(3-fluorophenyl)methanesulfonamide
CID 119975492
methyl 2-[(1-amino-2-methylpropan-2-yl)sulfamoyl]propanoate
CID 63194222
N-(1-amino-2-methylpropan-2-yl)-2-thiophen-2-ylethanesulfonamide;hydrochloride
CID 120874886
N-(1-amino-2-methylpropan-2-yl)-4-cyanobenzenesulfonamide
CID 55161784
N-(1-aminooxy-2-methylpropan-2-yl)propane-1-sulfonamide
CID 39242687

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide (CID 61124177) is N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide is CCS(=O)(=O)NC(C)(C)CN.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide?
The InChIKey is AOXAJQISINPWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O2S/c1-4-11(9,10)8-6(2,3)5-7/h8H,4-5,7H2,1-3H3.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide?
N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide has a molecular weight of 180.27 g/mol, XLogP of -0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)ethanesulfonamide is sourced from PubChem (CID 61124177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).