N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride

C5H15ClN2O2S — CID 54592675

IUPACN-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride
SMILESCC(C)(CN)NS(C)(=O)=O.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-5(2,4-6)7-10(3,8)9;/h7H,4,6H2,1-3H3;1H
InChIKeyAAOITSFLIQUGFP-UHFFFAOYSA-N
MW202.71 g/mol
LogP-0.31
Rot. Bonds3

About N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride

N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride (PubChem CID 54592675) has the molecular formula C5H15ClN2O2S and a molecular weight of 202.71 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride
PubChem CID54592675
Molecular FormulaC5H15ClN2O2S
Molecular Weight202.71 g/mol
Exact Mass202.05
IUPAC NameN-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride
SMILESCC(C)(CN)NS(C)(=O)=O.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-5(2,4-6)7-10(3,8)9;/h7H,4,6H2,1-3H3;1H
InChIKeyAAOITSFLIQUGFP-UHFFFAOYSA-N
XLogP-0.31
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride (CID 54592675) is N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride is CC(C)(CN)NS(C)(=O)=O.Cl.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride?
The InChIKey is AAOITSFLIQUGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S.ClH/c1-5(2,4-6)7-10(3,8)9;/h7H,4,6H2,1-3H3;1H.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride?
N-(1-amino-2-methylpropan-2-yl)methanesulfonamide;hydrochloride has a molecular weight of 202.71 g/mol, XLogP of -0.31, 3 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)methanesulfonamide;hydrochloride is sourced from PubChem (CID 54592675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).